smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COc1cc(NC(=O)N2CCc3ccccc32)cc(OC)c1 217274063 ITUGSXJXCKPGBX-UHFFFAOYSA-N 298.342 3.298 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc2c(c1)CCC2 217634365 OEOFXZWPOKCVHF-JVPBZIDWSA-N 284.447 3.453 70 20 CGID COCc1nc(C)cc(N[C@@H]2CCCc3sccc32)n1 161067404 OJIUEPCBAULFFI-GFCCVEGCSA-N 289.404 3.482 70 20 CGID CC[C@@H](NC(=O)c1cc(C)ncn1)c1ccc(Cl)cc1 161360099 UFGJKGYCUCUHMH-CYBMUJFWSA-N 289.766 3.320 70 20 CGID Cc1nc(COC(=O)CSC(F)(F)F)c(C)s1 160056669 LQSBGAHIWFEYPU-UHFFFAOYSA-N 285.312 3.056 70 20 CGID C[C@H](C(=O)N(C)c1ccc2c(c1)OCO2)c1cccs1 160153864 HZOBGMOVPUNUGW-JTQLQIEISA-N 289.356 3.243 70 20 CGID CC[C@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@H](C)O1 160263032 KHBBTSZLQPXXHX-JSGCOSHPSA-N 267.413 3.229 70 20 CGID CC1(NC(=O)N[C@H]2CCCOc3ccccc32)CCC1 160392566 FGTBUXWZHBPZFN-ZDUSSCGKSA-N 274.364 3.142 70 20 CGID CC(C)C[C@H](CO)NC(=O)c1ccc(C(C)(C)C)s1 160671618 VTPHNFRJJVSMMD-LLVKDONJSA-N 283.437 3.182 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(N(C)C)nc1 160900393 SWKMWRMIJHXGER-ZFWWWQNUSA-N 289.423 3.188 70 20 CGID CCCc1nc(CN(C)C2(C(=O)OC)CCCC2)cs1 159461950 AMKJUXHQRPDNMY-UHFFFAOYSA-N 296.436 3.013 70 20 CGID Cc1cc(Cl)cc(C(=O)Nc2ncccc2O)c1 159562089 XUGRSDSLTMROTK-UHFFFAOYSA-N 262.696 3.001 70 20 CGID Cc1cc(N[C@H](C)c2ccc(F)c(F)c2)nn1C 159595377 BTYNYCCQBMQEHQ-SECBINFHSA-N 251.280 3.180 70 20 CGID Cc1cccc(C(=O)NCc2ccc(F)cc2F)c1F 161439910 QXRXANUGYGFOAU-UHFFFAOYSA-N 279.261 3.342 70 20 CGID Cc1nccc(NC(C)(C)CN(C)Cc2ccccc2)n1 159759283 QXJNBWQVUBLEFK-UHFFFAOYSA-N 284.407 3.108 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)NCC1(CCOC)CC1 161109303 XUEFPDQVWSJFAG-CABCVRRESA-N 296.455 3.413 70 20 CGID Cc1ccccc1-c1nnc(SCc2ccnn2C)o1 161187386 NJGLMEFDNKUBJV-UHFFFAOYSA-N 286.360 3.071 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)NC(C)(C)CC 160021173 ISAKHOMDOKXXBV-LLVKDONJSA-N 298.452 3.472 70 20 CGID CN(C)C(=O)c1cccc(COc2ccc3[nH]ccc3c2)c1 160071542 IUPKFGWNJPKUDL-UHFFFAOYSA-N 294.354 3.449 70 20 CGID CC(C)Oc1ccc(CN[C@@H](C(C)C)C2CC2)cn1 160101634 FVQFGOILZUWLOT-INIZCTEOSA-N 262.397 3.393 70 20 CGID CC[C@H](CC(=O)NCC1(O)CCCC1)c1ccc(C)cc1 160227922 FZMOAQIRBMEOQN-OAHLLOKOSA-N 289.419 3.300 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 160297840 ZPPUVGKBRCNUCK-GFOCRRMGSA-N 289.419 3.094 70 20 CGID CCOCCC1(CNC(=O)C[C@@H]2C=CCC2)CCC1 160521378 UPYDPSCTLOZJKZ-CQSZACIVSA-N 265.397 3.056 70 20 CGID CCn1c(SCCCF)nc2ccc(F)cc2c1=O 159657607 MVACJKWLHIKUDB-UHFFFAOYSA-N 284.331 3.007 70 20 CGID Cc1nccc(C(=O)N2C[C@H](C)CSc3ccccc32)n1 159590716 HJXKGANQMYVURH-NSHDSACASA-N 299.399 3.174 70 20 CGID CCOc1cccc(CN[C@@H](C)c2cncc(F)c2)c1 159407233 NEJCKRFVXSRJMQ-LBPRGKRZSA-N 274.339 3.470 70 20 CGID CC(C)(C)C[C@H](O)CNCc1cccc2c1OC(C)(C)C2 217811214 IOPSQBFPRJIRGA-HNNXBMFYSA-N 291.435 3.287 70 20 CGID Cc1csc(NC(=O)c2cc(F)cc3cccnc23)n1 161034519 UXDZFERUKOYWLG-UHFFFAOYSA-N 287.319 3.391 70 20 CGID C[C@@H](CC(=O)N(C)[C@@H](C)C1(C)CC1)c1ccncc1 161418843 SJUJUSIALIVUSG-STQMWFEESA-N 260.381 3.222 70 20 CGID CO[C@@H](C(=O)Nc1ccccc1N(C)C)c1ccccc1 161492585 VKSMOKWTNLGVQG-MRXNPFEDSA-N 284.359 3.079 70 20 CGID CC(C)NC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F 161509751 KZOIELQXBLCIKJ-JTQLQIEISA-N 296.239 3.276 70 20 CGID C[C@@H](Cc1ccc(F)cc1)NC[C@](C)(O)c1ccsc1 160014112 JHEIASYAXTUVBF-LRDDRELGSA-N 293.407 3.316 70 20 CGID C[C@H](NCCSc1ccc(Cl)cc1)[C@@H]1CCOC1 160052475 DACSURIMADVIPA-NWDGAFQWSA-N 285.840 3.447 70 20 CGID COc1ccc(NC(=O)NC2C[C@H](C)O[C@@H](C)C2)c(C)c1 160371679 MJMCQUUDOFTCFW-RYUDHWBXSA-N 292.379 3.081 70 20 CGID CCC[C@@H](C(=O)NCc1ccc2c(c1)OCO2)C(C)C 160447033 WNSMSUMIOPXHRS-CYBMUJFWSA-N 277.364 3.104 70 20 CGID Cc1ccc(NC(=O)[C@H]2CCCCO2)c2cccnc12 160706210 ACUUDRHISCWPQB-CQSZACIVSA-N 270.332 3.051 70 20 CGID Cc1cccc([C@@H]2CCCN2C(=O)C[C@H]2CCCN2)c1C 160723306 RGETZEVAEQYHSL-WBVHZDCISA-N 286.419 3.109 70 20 CGID CC(C)OCCNc1nc2ccc(F)cc2s1 160742859 UVWOBJNYEFLWPT-UHFFFAOYSA-N 254.330 3.272 70 20 CGID CCc1cc(O)nc(CN(CC)Cc2ccccc2C)n1 160810326 DWBBUNSZZPDPHG-UHFFFAOYSA-N 285.391 3.075 70 20 CGID C[C@H](NC(=O)C(C)(C)F)c1cccc(N2CCCC2)c1 159496459 KYTZOJQUCWLOPE-LBPRGKRZSA-N 278.371 3.212 70 20 CGID Cc1ccc(-n2ccnc2SCCn2ccnc2)c(C)c1 159693741 IRTLVJRCYDNFQY-UHFFFAOYSA-N 298.415 3.478 70 20 CGID CCn1c(NC(=O)C2=CCCC2)nc2ccccc21 159898851 DDFUEMVUTFWLSU-UHFFFAOYSA-N 255.321 3.105 70 20 CGID COc1ccc(-c2nnc(NCC3CC3)s2)cc1 216848925 BLZZNMPZDWKKQX-UHFFFAOYSA-N 261.350 3.036 70 20 CGID CCC(CC)NC(=O)Nc1cc(Br)ccn1 217305037 ZNBPIJKLHXNJIP-UHFFFAOYSA-N 286.173 3.154 70 20 CGID COc1ccccc1CN(C(=O)C[C@@H](C)SC)C1CC1 160428982 NVRJPLQBWPFVHP-GFCCVEGCSA-N 293.432 3.328 70 20 CGID O=C(CCC1CC1)Nc1cccc(OCCF)c1 160432179 WEYBGMYVVZTCCM-UHFFFAOYSA-N 251.301 3.164 70 20 CGID CCCC1(CNC(=O)[C@H](C)OCCC(C)C)CC1 160562380 QZXJFUHMLLNSOT-ZDUSSCGKSA-N 255.402 3.134 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CCn1cc(C)cn1 161267674 RQDMZTAFFNHIDY-LSDHHAIUSA-N 277.412 3.009 70 20 CGID COc1cc(NCc2c(C)nc3ccccn23)ccc1F 160024666 LWIUGIFWYDFEJD-UHFFFAOYSA-N 285.322 3.403 70 20 CGID O=C(Oc1ccc(F)cc1)c1csc([C@H]2CCCO2)n1 160489517 FFTFGYQPDIYBNJ-GFCCVEGCSA-N 293.319 3.353 70 20 CGID CC[C@@H](C)OCC(=O)Nc1nc(C(C)(C)C)cs1 160510862 NYQUFHABWRWOIF-SECBINFHSA-N 270.398 3.194 70 20 CGID C[C@H](C(=O)NCC1(C2CC2)CC1)c1ccccc1F 159730097 XRBFKGQEEUVKBJ-NSHDSACASA-N 261.340 3.236 70 20 CGID COc1cc(NC(=O)c2ccc(C)c(O)c2)ccc1F 160406050 QRQXRRJWKGLUIR-UHFFFAOYSA-N 275.279 3.101 70 20 CGID COc1ccc(CN[C@@H]2CCOC(C)(C)C2)cc1Cl 160429076 IPMOVEIUJJOJHV-GFCCVEGCSA-N 283.799 3.396 70 20 CGID CCOC(=O)c1ccc(N2CCC3(CCCC3)CC2)nc1 217506099 BFDZCJUEMGELNO-UHFFFAOYSA-N 288.391 3.419 70 20 CGID O=C(CCCOc1ccccc1F)NCC1(C2CC2)CC1 160042222 VKTMEGAWWQTBRC-UHFFFAOYSA-N 291.366 3.291 70 20 CGID CCCN(Cc1ccccc1)Cc1cnc2cnccn12 160475863 UREVPPOVRRJWEJ-UHFFFAOYSA-N 280.375 3.142 70 20 CGID CN(C)c1ccc(CN[C@H](c2ccccc2)C2CC2)cn1 159660537 IRPVCTULUBUSGJ-GOSISDBHSA-N 281.403 3.389 70 20 CGID CCOC(=O)Nc1ccc(NC(=O)C[C@H](C)SC)cc1 159517459 BYGFWWWEXWIASB-JTQLQIEISA-N 296.392 3.335 70 20 CGID NCc1ccc(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)cc1 159719032 VSWMBTYMIZHLRI-ZWKOTPCHSA-N 294.398 3.211 70 20 CGID CCc1nc(CN2CC[C@@H]3CCCC[C@@H]32)cs1 159696573 LPFOIUBIXMKSAB-AAEUAGOBSA-N 250.411 3.470 70 20 CGID CC[C@@H](NCCOC[C@@H]1CCCO1)c1ccc(F)cc1 160931725 GJDTVMSJFDOIQE-JKSUJKDBSA-N 281.371 3.062 70 20 CGID FC(F)(F)SCCNc1ncnc2c1CCCC2 217801253 DHKHZSTYHLWIRM-UHFFFAOYSA-N 277.315 3.020 70 20 CGID Cc1ccc(CCNC(=O)Nc2ccc(Cl)cn2)cc1 217307953 NUFGODMHMBINPC-UHFFFAOYSA-N 289.766 3.408 70 20 CGID Cc1cccc(C(=O)N[C@H](C)Cc2ccco2)c1F 161450069 XUIJCIPXYCROGO-LLVKDONJSA-N 261.296 3.088 70 20 CGID CCC[C@H](C)CC(=O)Nc1cccc(S(=O)(=O)F)c1 769661199 YKRWHPYTDDHHJF-JTQLQIEISA-N 287.356 3.110 70 20 CGID CC[C@H](COC)N[C@H](c1ccc2c(c1)OCCO2)C(C)C 161040324 BAZSQRFZQCCWPT-PBHICJAKSA-N 293.407 3.170 70 20 CGID CC(C)Oc1ccc([C@@H](C)NC(=O)[C@H]2CCCCO2)cc1 161081047 GOYNNZBNXUQFAH-CZUORRHYSA-N 291.391 3.220 70 20 CGID Cc1ccc2cc(C(=O)N[C@@H](C)C[C@H]3CCCO3)ccc2n1 161410904 PRRBSIGBBCHKNI-XJKSGUPXSA-N 298.386 3.231 70 20 CGID CC(C)n1nccc1NC(=O)N1CC[C@@H]2CCCC[C@@H]21 160039135 YTPZRRFCOGZWNE-STQMWFEESA-N 276.384 3.260 70 20 CGID CCc1c(Cl)nc(C)nc1N[C@@H]1CCO[C@@H](C2CC2)C1 160384426 BCZUARCUSNCIBQ-DGCLKSJQSA-N 295.814 3.370 70 20 CGID CCCC1(CNC(=O)c2ccccc2OCCOC)CC1 160438371 DQFAKBYMXTXDPM-UHFFFAOYSA-N 291.391 3.022 70 20 CGID CCCCN(C)C(=O)[C@H]1C[C@H]1c1sccc1C 160593454 RVQYIAQYMGXFCF-NEPJUHHUSA-N 251.395 3.419 70 20 CGID CCO[C@@H]1C[C@@H](NCC2(N(C)C)CCCC2)C12CCCC2 160675913 HQVGSEHWRQUIER-HZPDHXFCSA-N 294.483 3.188 70 20 CGID Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCC[C@H](C)C2)cn1 160730327 RUIDTSYEFDBSBB-GXTWGEPZSA-N 298.390 3.341 70 20 CGID COc1cc(C(=O)N2CCC[C@@H](C)c3ccccc32)on1 159817674 MQCSZPLTAPKYPM-LLVKDONJSA-N 286.331 3.227 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCCCCC2)n1 159666433 JXJNPZWODQVECQ-UHFFFAOYSA-N 278.400 3.337 70 20 CGID Cc1noc(C)c1N(C)C(=O)CCc1ccc(F)cc1F 159363079 FKPVRJLBBQKBBO-UHFFFAOYSA-N 294.301 3.165 70 20 CGID C/C=C(\C)C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1 159397955 KJIMXMSDZOSRDE-JVOXIWMLSA-N 274.364 3.120 70 20 CGID CCSCC[C@H](C)NC[C@@H](O)c1ccc(F)c(F)c1 160127396 DLUGSWBGKZGCKZ-IINYFYTJSA-N 289.391 3.120 70 20 CGID CCC[C@@](C)(NC(=O)c1cccc(C)c1Cl)C(=O)OC 160405251 JXDCVNWGSAHXKJ-OAHLLOKOSA-N 297.782 3.110 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cccs1 161033617 VMQUIDDPJVRNQL-UPJWGTAASA-N 252.427 3.272 70 20 CGID CCOC(=O)CCSc1nc2cc(C)ccc2o1 217961450 YLABKGRJSDBRRI-UHFFFAOYSA-N 265.334 3.182 70 20 CGID CN(Cc1ccccc1)CC(C)(C)NCc1ccccn1 159386385 RRLSQQLNNBHOSO-UHFFFAOYSA-N 283.419 3.082 70 20 CGID CC1(C)CCC(C(=O)N2CCO[C@H](c3ccco3)C2)CC1 161096289 ABEZAEYKJAAYQD-HNNXBMFYSA-N 291.391 3.396 70 20 CGID CC(C)[C@H](NCc1ccccc1N1CCOCC1)C1CC1 161472582 NQGNHMIGSRRUQI-SFHVURJKSA-N 288.435 3.047 70 20 CGID CCc1noc(CC)c1CNC(=O)N[C@H](C)CC(C)C 160050331 UYRGOYYPUIKGDL-LLVKDONJSA-N 281.400 3.033 70 20 CGID CC[C@H]1CCCC[C@@H]1NC(=O)c1ccc(CN(C)C)cc1 160101149 OKRMOKXCFNFMPZ-RDJZCZTQSA-N 288.435 3.447 70 20 CGID Cc1nc(-c2ccc(CNC(=O)C3=CCCC3)o2)cs1 160155953 CMFWCCFDCXWAHZ-UHFFFAOYSA-N 288.372 3.438 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1ncoc1C 160172983 CJRUHGRNKXSBKQ-JTQLQIEISA-N 275.304 3.218 70 20 CGID Clc1cncc(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160662052 PRMKPLNLGCXBPA-OLZOCXBDSA-N 289.766 3.462 70 20 CGID COc1cccc(NC(=O)COc2ccc(F)cc2C)c1 160719047 ZALYSDPJMBTCOE-UHFFFAOYSA-N 289.306 3.160 70 20 CGID O=C(Nc1ncc(Cl)s1)[C@H]1OCCc2ccccc21 160995009 BPYUFAXKYNJLIX-NSHDSACASA-N 294.763 3.049 70 20 CGID CCOc1ncccc1NC(=O)C[C@@H](C)c1ccncc1 159860405 UMAOQZLXQAQZAT-GFCCVEGCSA-N 285.347 3.008 70 20 CGID CCN1CC[C@H](NCCc2cc(C)cc(C)c2)[C@H](C)C1 159466341 RQPZYGVAYVMFEQ-AEFFLSMTSA-N 274.452 3.166 70 20 CGID c1ccc(Cc2noc(CN3CC[C@@H]4CCCC[C@@H]43)n2)cc1 159736405 ZMZKCMCLJAFXAD-HOTGVXAUSA-N 297.402 3.425 70 20 CGID C[C@H](O)CN(C)[C@@H]1CCc2c(Cl)cc(Cl)cc21 159385239 WHVGRMSKNCMNNB-ISVAXAHUSA-N 274.191 3.293 70 20 CGID CCN(CC(=O)N1C[C@H](C)C[C@@H](C)C1)c1ccc(F)cc1 216707386 SEZDWMGFHHDCAA-ZIAGYGMSSA-N 292.398 3.157 70 20 CGID CC(C)OCCNc1ncc(Cl)cc1Br 159631636 GLRKLINVVZINSN-UHFFFAOYSA-N 293.592 3.334 70 20 CGID C[C@@H]1CCCCN1C[C@@H](O)c1cc2ccccc2o1 216875866 SFTOUFHEBXJTMI-TZMCWYRMSA-N 259.349 3.341 70 20 CGID Clc1ccc2oc(SCCn3ccnc3)nc2c1 159400061 JPXQHMHZPDLLAM-UHFFFAOYSA-N 279.752 3.470 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1ncoc1C 161191560 PDVRNFOXGKMMLC-NWDGAFQWSA-N 250.342 3.024 70 20 CGID CCC[C@H](C(=O)N[C@H](C)c1cc2ccccc2o1)N(C)C 161279690 LFKKIQLLMQCBNK-TZMCWYRMSA-N 288.391 3.340 70 20 CGID CCCn1nc(C)c(C(=O)NCc2ccc(C)cc2)c1C 161313632 AOLRMCRNEUBYSJ-UHFFFAOYSA-N 285.391 3.148 70 20 CGID CCCCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160015981 VLMPRIMIDMLPOG-NSHDSACASA-N 261.243 3.418 70 20 CGID CC[C@H](NC(=O)c1cccc(F)c1)c1c(C)noc1C 160160870 TUEHZEKYQHRPQM-ZDUSSCGKSA-N 276.311 3.312 70 20 CGID Cc1ccc(C(=O)NC2CC2)cc1NCc1cccc(O)c1 160266552 YBGQUDWDLCLOCH-UHFFFAOYSA-N 296.370 3.205 70 20 CGID CC[C@@H](NCCC(=O)OC(C)C)c1ccc(F)cc1 160693651 KSUDAFLEFYGDOX-CQSZACIVSA-N 267.344 3.208 70 20 CGID Cc1cccc([C@@H]2CCCN2C(=O)CC2(N)CCC2)c1C 160723550 FBSTWVFVGWREOV-INIZCTEOSA-N 286.419 3.238 70 20 CGID CCCCO[C@H](C)C(=O)N[C@H]1CCc2c(OC)cccc21 159887538 NFUBKOAQLRWTKX-DOMZBBRYSA-N 291.391 3.004 70 20 CGID CN(C(=O)Nc1cccc2ccccc12)[C@H](CN)C1CC1 159906363 VOLHBEZPHWGMGH-MRXNPFEDSA-N 283.375 3.041 70 20 CGID CCCCn1ncc(NC(=O)NC[C@H]2CCCS2)c1C 159766052 ZCGDICBZNHUBBC-GFCCVEGCSA-N 296.440 3.009 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cccc(C)c1Cl 159571868 HNNRUIWGARVAPJ-SNVBAGLBSA-N 255.745 3.402 70 20 CGID Cc1cc(C)nc(N[C@@H]2CCCc3cc(N)ccc32)n1 159506947 ICEOLMDUFXXMCT-OAHLLOKOSA-N 268.364 3.165 70 20 CGID Cc1ccccc1CNC(=O)NCCc1ccc(F)cc1 217313812 IPTVKNAECDBGBU-UHFFFAOYSA-N 286.350 3.176 70 20 CGID Cc1ccc([C@@H](O)Cn2c(C)nc3c2CCCC3)cc1 216916221 ZTFSFBLISZKDHU-KRWDZBQOSA-N 270.376 3.112 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NCCc1ccncc1)C2 217898443 DGZMPGGIYBTHFM-ZOBUZTSGSA-N 258.409 3.429 70 20 CGID C1C[C@H]2[C@@H]3C[C@H](C[C@H]3NC3CCC4(CC3)OCCO4)[C@H]2C1 218018231 UWXAPSMSOAUCGQ-FYNNLBNCSA-N 291.435 3.086 70 20 CGID CC(=O)c1c(F)cccc1N[C@H]1CCOC(C)(C)C1 160633365 NONRRSXFEUMXRJ-NSHDSACASA-N 265.328 3.398 70 20 CGID CSc1cccc(NC2CCC(NC(C)=O)CC2)c1 161080213 GYAUBYMOBKSCIZ-UHFFFAOYSA-N 278.421 3.268 70 20 CGID Cc1ccc([C@@H](C)NC(=O)NCc2ccccc2CO)cc1 161117789 DKVJBGLYZGPFIT-CQSZACIVSA-N 298.386 3.048 70 20 CGID CCc1cc(NC(=O)c2cnc3c(c2)ncn3C)ccc1C 161128067 WNCVOFVYLSHCBF-UHFFFAOYSA-N 294.358 3.091 70 20 CGID COC(CN1Cc2ccccc2C[C@H]1c1ccccc1)OC 161289859 GPSGXLVGFQYTAG-SFHVURJKSA-N 297.398 3.405 70 20 CGID Cc1cc(OCC(=O)N2[C@@H](C)CC[C@@H]2C)ccc1Cl 161408249 MDUCIUTYSAOPEF-RYUDHWBXSA-N 281.783 3.427 70 20 CGID Cn1cccc1CNc1ccc(C(F)(F)F)nc1 160067799 KROPXXLGDISQRT-UHFFFAOYSA-N 255.243 3.051 70 20 CGID CC(C)Oc1ccc(CN[C@H](C)c2ccco2)cn1 160092949 DIVUOFPNUFPDPZ-GFCCVEGCSA-N 260.337 3.313 70 20 CGID CC[C@@H](CC(=O)NC[C@H]1CCCN1C)c1ccc(C)cc1 160130428 GCNNKGGWKZXYNK-DOTOQJQBSA-N 288.435 3.089 70 20 CGID Cc1ccc(C(=O)C(=O)N[C@H]2CCCc3sccc32)cc1 160448873 RVMGPEQGMQBKGT-AWEZNQCLSA-N 299.395 3.433 70 20 CGID CC(C)Cc1ccc(CC(=O)N(C)Cc2cccn2C)cc1 160767367 BLTZXNCYAWIVGA-UHFFFAOYSA-N 298.430 3.425 70 20 CGID COc1ccc(NC(=O)C[C@@H](C)SC)c2cccnc12 160967037 NCWSTUJRCWUEGH-SNVBAGLBSA-N 290.388 3.324 70 20 CGID CC[C@H](C)OCC(=O)N(CC1CCCCC1)C1CC1 159802629 CIHNGXZLEJAOJU-ZDUSSCGKSA-N 267.413 3.373 70 20 CGID COc1ccc(N(C)C(=O)CC[C@H]2CCCCO2)cc1F 159863967 GDBFLWIPEQJPAQ-CYBMUJFWSA-N 295.354 3.146 70 20 CGID C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1C=CCCC1 159790164 HAWSPGXVMSZQNE-DZGCQCFKSA-N 288.391 3.073 70 20 CGID CN(C)[C@H](CNCc1coc2ccccc12)c1ccco1 159795568 ZDGCYPHWHXKKRL-OAHLLOKOSA-N 284.359 3.418 70 20 CGID COC(CN(C)Cc1cccc(Cl)c1Cl)OC 160370206 LGRZYSMNSACQMB-UHFFFAOYSA-N 278.179 3.044 70 20 CGID CCOCCCN(Cc1ccccc1OC)C1CC1 159409242 WROMULDKMKATDU-UHFFFAOYSA-N 263.381 3.086 70 20 CGID FC(F)(F)c1cccc(N[C@@H]2CCN3CCCC[C@@H]23)n1 217389021 LVYDYAQFWWPREO-MNOVXSKESA-N 285.313 3.139 70 20 CGID O=C(Nc1ccccc1OCC1CC1)NC1CC=CC1 161194769 WLVQDCFLSACELV-UHFFFAOYSA-N 272.348 3.316 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CCC(=O)N(CC)CC 161209370 VNYHDWMSQZAWFL-GJZGRUSLSA-N 296.455 3.062 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Cc1c(C)nn(C)c1C 161282572 AMZVEYYBXVLIFT-ZBFHGGJFSA-N 291.439 3.007 70 20 CGID CCO[C@H]1C[C@H](N[C@H](CC)c2cnn(C)c2)C1(CC)CC 161291926 RUYHKXVJQVEZOE-PMPSAXMXSA-N 293.455 3.445 70 20 CGID O=C(c1ccoc1)N1CC[C@@H](Oc2ccccc2Cl)C1 161375852 YMYWQHAAIBZMCI-GFCCVEGCSA-N 291.734 3.227 70 20 CGID COCc1ccccc1CNC(=O)c1ccc(C(C)C)nc1 161455856 YTFTZJCSRGEDDJ-UHFFFAOYSA-N 298.386 3.281 70 20 CGID C[C@@H](Cc1ccc(Cl)cc1)C(=O)NC1(C)CCOCC1 161510594 VLHBIVSIDJKXDW-LBPRGKRZSA-N 295.810 3.204 70 20 CGID CC(C)c1cccc(NC(=O)N[C@H]2CC[C@H](O)CC2)c1 160284085 OCAPVSBMTPIVOX-OTVXOJSOSA-N 276.380 3.235 70 20 CGID CC(=O)Nc1ccc(NC(=O)c2cccn2C(C)C)cc1 160416377 HNPFJGAFTBLIPP-UHFFFAOYSA-N 285.347 3.280 70 20 CGID O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)NCC1(C2CC2)CC1 160728139 UHIKYQWYQFOKPD-BRWVUGGUSA-N 296.414 3.062 70 20 CGID COc1cc(CNC(=O)N2CC[C@H](C)[C@H](C)C2)ccc1C 160862402 NHGDSIIBELVBJO-GXTWGEPZSA-N 290.407 3.191 70 20 CGID Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)[C@@H](N)C(C)(C)C)C1 159889217 KQJZQBORIWIDBY-SQWLQELKSA-N 288.435 3.073 70 20 CGID CC(C)CN1CC[C@@H](CNc2nc(C(C)(C)C)ns2)C1 159944558 QLYSEZBPYAFVRT-LBPRGKRZSA-N 296.484 3.225 70 20 CGID CC[C@@H](NC(=O)c1ccccc1C)c1c(C)noc1C 159996579 JZAJCAGOWMQCMX-CQSZACIVSA-N 272.348 3.481 70 20 CGID CC[C@H]1CCCC[C@@H]1NCc1noc(C(C)(C)C)n1 161433681 LHUBTFIMHASTON-RYUDHWBXSA-N 265.401 3.426 70 20 CGID CCn1cc([C@H](C)NC[C@]2(N(C)C)CCC[C@@H](C)C2)cn1 217458486 FDUXBMPXODVXRO-VYDXJSESSA-N 292.471 3.064 70 20 CGID Cc1ccc(C(=O)NC2CC(C)C2)c(Br)c1 159939496 KXVCTZVNZZNQHF-UHFFFAOYSA-N 282.181 3.286 70 20 CGID CCc1noc(C)c1CNc1ccc(C)cc1OC 159410648 CJVQPDQPZRSEEB-UHFFFAOYSA-N 260.337 3.475 70 20 CGID C[C@@H](C(=O)OC(C)(C)C)N(C)c1nc(C(C)(C)C)ns1 159822402 IHOGWQFDFVXPIU-VIFPVBQESA-N 299.440 3.002 70 20 CGID CC(C)CC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 161449099 LNMVFEPQAJXDFQ-GFCCVEGCSA-N 281.783 3.366 70 20 CGID CCOCCC1(CNC(=O)c2cc(OC)cs2)CCC1 161345204 JFLPWMOGDNHOGE-UHFFFAOYSA-N 297.420 3.083 70 20 CGID CCC[C@@H](C)[C@H]1CCCN1Cc1nnc(C)n1CCC 161429092 QYGBAEWPPQIIHA-UKRRQHHQSA-N 278.444 3.397 70 20 CGID Cc1nc2ccccn2c1CN(C)[C@@H](C)C1(C)CC1 161442784 POIUEOFCZRKTBL-ZDUSSCGKSA-N 257.381 3.263 70 20 CGID CC[C@@H](C)[C@H](N)C(=O)N(C)c1ccc(C(C)C)cc1 161460598 ZARUKFIPDWAOGU-DOMZBBRYSA-N 262.397 3.146 70 20 CGID CCCCc1cc(NC(=O)CC2CCSCC2)[nH]n1 160314336 PVDDQMVFYKCISS-UHFFFAOYSA-N 281.425 3.224 70 20 CGID CC(C)c1ccc(OCCN[C@@H](C)[C@@H]2CCOC2)cc1 160329030 XFUDZILLZUGMGG-GOEBONIOSA-N 277.408 3.203 70 20 CGID CC[C@H](NC(=O)c1ccccc1OC)c1c(C)noc1C 160433628 OQRFRDPMNUAJTA-ZDUSSCGKSA-N 288.347 3.181 70 20 CGID Cc1ccc2c(CC(=O)N(C)Cc3cccn3C)coc2c1 160514316 UVYKZDLCVKMILQ-UHFFFAOYSA-N 296.370 3.281 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1c1nc(-c2ccc(F)c(F)c2)no1 160997117 JYCMEZLOVRPXLN-LDYMZIIASA-N 292.285 3.488 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(C)nc2onc(C)c12 159606493 HVCQRGKDBRISCM-YPMHNXCESA-N 287.363 3.148 70 20 CGID CC1=C(C(=O)NCCc2c(C)cccc2C)CCCO1 159861722 IALXSFKSZQCONA-UHFFFAOYSA-N 273.376 3.047 70 20 CGID CC(C)(C)NC(=O)N[C@@H]1CCSc2c(F)cccc21 159763224 RCXLAKKRIZTQJC-LLVKDONJSA-N 282.384 3.460 70 20 CGID Cc1cccc([C@@H]2CCCN2CCCOC(C)C)n1 159779629 GJUPFSHPUVWLCB-INIZCTEOSA-N 262.397 3.342 70 20 CGID CC[C@@H](c1ccncc1)N(C)C(=O)OC(C)(C)C 159729113 MPAJEYICBRTOKA-LBPRGKRZSA-N 250.342 3.400 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2ccccn2)n1 159792706 WDVYTKXBRRSOCC-INIZCTEOSA-N 253.349 3.122 70 20 CGID CO[C@@H]1CCCC[C@@H]1Nc1nc(C(C)(C)C)ns1 159674919 IJIAYVAGJAGLRO-VHSXEESVSA-N 269.414 3.205 70 20 CGID C[C@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCC1CC1 217987455 FXGZZLVHUAHRNN-GUYCJALGSA-N 296.455 3.460 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)c2ccoc2C)n1 161347771 ADCVTNGRYCBDGY-UHFFFAOYSA-N 296.330 3.188 70 20 CGID COc1ccc(OC)c(CCN[C@H](C)c2ccco2)c1 161426510 XZZKJKKQGFVCJR-GFCCVEGCSA-N 275.348 3.190 70 20 CGID CCCCn1ncc(NC(=O)N2[C@@H](C)CC[C@@H]2C)c1C 160110067 HFYSKRLGLIRHRS-RYUDHWBXSA-N 278.400 3.396 70 20 CGID C[C@@]1(NC(=O)Nc2ccc3c4c(cccc24)CC3)CCOC1 160171149 CHXZYBCVQFGNQM-GOSISDBHSA-N 296.370 3.239 70 20 CGID C[C@@H](CC(=O)N(C)Cc1cccn1C)C(C)(C)C 160487423 ZUDYEYXAXZOTCK-LBPRGKRZSA-N 250.386 3.056 70 20 CGID CN(C(=O)c1c(-n2cccc2)sc2c1CCC2)C1CC1 160544207 YYVAURPKEDNMFF-UHFFFAOYSA-N 286.400 3.262 70 20 CGID CC[C@@H](C(=O)Nc1nc(C)ns1)c1ccc(F)cc1 160560725 PZRQUFUTSLUWQF-LLVKDONJSA-N 279.340 3.118 70 20 CGID CC[C@H](C)N(C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 160771683 DVCRLSATPGITLI-IMJJTQAJSA-N 290.407 3.347 70 20 CGID COc1ccc(C)cc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159640406 SRYSPERWAHAZIN-OIISXLGYSA-N 287.403 3.051 70 20 CGID C[C@@H](c1ccco1)N(C)C(=O)c1ccc(CN(C)C)cc1 159910850 XCWABVSSHHXMPO-ZDUSSCGKSA-N 286.375 3.174 70 20 CGID O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCCS1 159932670 OQQZWNCGTWTXEW-UWVGGRQHSA-N 291.294 3.124 70 20 CGID CC[C@H]1C[C@H](Nc2ccc(F)c(OC)c2)CCO1 159967256 YQSYSJVLYUOSFY-NEPJUHHUSA-N 253.317 3.204 70 20 CGID CC[C@H](C)[C@@H](O)CNC(=O)CCC(C)(C)c1ccccc1 159399816 PQWMXIFMFQZGQP-HOCLYGCPSA-N 291.435 3.268 70 20 CGID Fc1cc(CN[C@@H]2CCN3CCCC[C@@H]23)ccc1Cl 218314885 VJFGESGPVSAVPE-CABCVRRESA-N 282.790 3.196 70 20 CGID O=C(c1cn[nH]c1)N1CCCC[C@@H]1CCCc1ccccc1 161163261 RBSGZSNQCQXIPL-QGZVFWFLSA-N 297.402 3.427 70 20 CGID CNC[C@@H](C)C(=O)N1CCCC[C@H]1c1cccc(C)c1C 161338348 OMZIZDFRFQKVRE-PBHICJAKSA-N 288.435 3.213 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cc(F)cc(Cl)c1O 160407140 XNDWWQSENSFXLM-HTQZYQBOSA-N 271.719 3.198 70 20 CGID CC1(C)C[C@H](NC(=O)Nc2cccnn2)c2ccccc21 160523542 XXROSJFGUGIFAR-ZDUSSCGKSA-N 282.347 3.021 70 20 CGID CCCC[C@@H](CC)CC(=O)N[C@H](CCO)C(C)C 160561918 RCNFUDPAVXBSLW-ZIAGYGMSSA-N 257.418 3.116 70 20 CGID CC(C)(C)C1=CCN(C(=O)NC2CCCC2)CC1 160794332 YMTPOPURSCJBSI-UHFFFAOYSA-N 250.386 3.317 70 20 CGID CC(C)n1cccc1C(=O)NCc1ccc(F)cc1 160948302 VGNUPCFOZVSHPL-UHFFFAOYSA-N 260.312 3.138 70 20 CGID CCO[C@@H](CCNC(=O)C[C@H](C)c1ccncc1)C(C)C 160971441 IFSGPFJQXLPAPQ-HOCLYGCPSA-N 292.423 3.143 70 20 CGID C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C[C@@H](C)O 159478006 LGUMRMXDQZORHP-ZJUUUORDSA-N 261.287 3.079 70 20 CGID CC(C)c1ccc(C(=O)NCc2cccs2)cn1 159746391 PLXVQQDWSLCWCV-UHFFFAOYSA-N 260.362 3.197 70 20 CGID CC[C@H](C(=O)NC[C@@H]1CCCCO1)c1ccc(F)cc1 159370612 CYYCMNNNIGSFMH-GJZGRUSLSA-N 279.355 3.005 70 20 CGID COc1cc(N[C@@H]2CCO[C@@H](C(C)C)C2)ccc1F 160080082 ZHTBFFVMGYDWLL-TZMCWYRMSA-N 267.344 3.450 70 20 CGID CN(Cc1csc(C2CC2)n1)C[C@H]1CCCCO1 161450470 NRQSUWFBJAZSRV-CYBMUJFWSA-N 266.410 3.021 70 20 CGID FC(F)(F)c1ccccc1NCc1nnc2n1CCCC2 217317444 JLYDAVMBKLJVIP-UHFFFAOYSA-N 296.296 3.245 70 20 CGID C[C@@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CCCC1 776364025 PQNGDWGRIKGOCJ-SNVBAGLBSA-N 299.367 3.110 70 20 CGID Cc1cc(C)cc(OCCCCS(=O)(=O)Cl)c1 100495440 AQALFWVVRNLSDL-UHFFFAOYSA-N 276.785 3.031 70 20 CGID CC[C@H](C)OCC(=O)Nc1cccc(COCC2CC2)c1 161388080 GJIIMKDDBJJSKE-ZDUSSCGKSA-N 291.391 3.367 70 20 CGID COCC(C)(C)c1nc(-c2ccc(F)c(C)c2)no1 161494057 YWDIPZIWDCRNST-UHFFFAOYSA-N 264.300 3.108 70 20 CGID C/C=C(\C=C\C(=O)N[C@H](C)CCc1cccn1C)CC 161506988 CUWNLAUXRQILPN-JPFHUXDQSA-N 274.408 3.375 70 20 CGID CCCn1nccc1CNc1ccc(C)c(NC(C)=O)c1 160068454 MIVLFPCCZLWVES-UHFFFAOYSA-N 286.379 3.172 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCCc2nc(C)sc21 160132070 SLYJTDONJLSXKD-DGCLKSJQSA-N 281.469 3.149 70 20 CGID COc1ccc(O)c(NC(=O)c2ccc(C(C)C)nc2)c1 160735961 GSNPAFYINNXMIS-UHFFFAOYSA-N 286.331 3.172 70 20 CGID CC[C@@H](C(=O)NC[C@@]1(C)CCCO1)c1ccc(F)cc1 160946969 HUWFJOMCTKEQSK-GDBMZVCRSA-N 279.355 3.005 70 20 CGID CC(C)CNC(=O)NOCc1ccc(C(F)(F)F)cc1 160984241 YOJIBWCMSHQAJL-UHFFFAOYSA-N 290.285 3.092 70 20 CGID CC[C@@H](C)OCC(=O)N1CCC[C@H]1c1cccc(F)c1 159871508 CJPSMKCBSGGLKX-DOMZBBRYSA-N 279.355 3.304 70 20 CGID C[C@H]1CCC[C@@H](C(=O)N2CCO[C@H](c3ccccc3)C2)C1 159687999 BROHCDNPAQBBLN-UAGQMJEPSA-N 287.403 3.413 70 20 CGID COCC(C)(C)C(=O)Nc1nc(-c2ccccc2)cs1 159573578 WACKUSBWGZAOEU-UHFFFAOYSA-N 290.388 3.421 70 20 CGID COc1cc(NCc2ccc(NC(C)=O)cc2)ccc1F 159982045 NUZKIDKNCSLQIR-UHFFFAOYSA-N 288.322 3.405 70 20 CGID Cc1cccc(C)c1CNc1cccc(NC(N)=O)c1 160420783 MPRUSXRYJLCWMV-UHFFFAOYSA-N 269.348 3.406 70 20 CGID CCNCC1CCN(Cc2cc(F)cc(Cl)c2)CC1 161152561 KRHHRUKDTJKVEM-UHFFFAOYSA-N 284.806 3.301 70 20 CGID C[C@H](c1cccs1)N(C)C(=O)[C@@H](O)c1ccccc1 159930476 YKCJRDRJWXFRGN-RISCZKNCSA-N 275.373 3.001 70 20 CGID C[C@@H](OC1CCCCCC1)C(=O)N(C)Cc1cccn1C 161015723 TWYREFHYSBIOQX-CQSZACIVSA-N 292.423 3.111 70 20 CGID CC[C@@H](CNC(=O)C(CC)(CC)CN)c1ccccc1 161168182 VOPXHIAFOQPJTP-AWEZNQCLSA-N 276.424 3.062 70 20 CGID CCOc1ccc(NC(=O)N[C@@]2(C)CCOC2)cc1Cl 161316020 QHPSALJCOYRNKF-AWEZNQCLSA-N 298.770 3.039 70 20 CGID CC(C)[C@H](C)CC(=O)N1CCO[C@H](c2cccs2)C1 161466270 ZJXMVWZFYKAYOS-OLZOCXBDSA-N 281.421 3.330 70 20 CGID CCCn1c(C)nnc1CN(C)Cc1cc2ccccc2o1 160464950 FIEFRDVCEVUOMZ-UHFFFAOYSA-N 298.390 3.375 70 20 CGID COc1ccsc1C(=O)N1CCc2c(F)cccc2C1 160951719 GTMAHQJBBVMTCJ-UHFFFAOYSA-N 291.347 3.094 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cccc(F)c1 160963950 ZRMDGZDGZGPFST-OAHLLOKOSA-N 291.366 3.437 70 20 CGID CCc1ccc(CNCc2ccn(C(C)C)n2)cc1 217823261 XRPFPDGXWDFFGB-UHFFFAOYSA-N 257.381 3.316 70 20 CGID CCc1ccc(CC(=O)NC[C@@H]2Cc3ccccc32)cc1 161046057 BZUQSIUVCYEYAW-KRWDZBQOSA-N 279.383 3.248 70 20 CGID C/C=C/C=C/C(=O)N[C@@H]1CCOC2(CCCCC2)C1 161464537 GLZZOXJKUGSJAB-MJOWELMCSA-N 263.381 3.117 70 20 CGID O=C(CCCN1C[C@@H]2CCC[C@H]2C1)c1ccccc1 160039291 FLHWJOLJAZMEJK-HOTGVXAUSA-N 257.377 3.381 70 20 CGID CC(C)OC(=O)CCCNc1nc2cc(F)ccc2o1 160256349 VBEVVGHMMLPJCE-UHFFFAOYSA-N 280.299 3.111 70 20 CGID CC[C@@H](NC(=O)[C@H]1CCCCO1)c1ccc(Cl)cc1 160502884 MBMZUIFERIJSKD-ZIAGYGMSSA-N 281.783 3.476 70 20 CGID CN(C)c1ccc(CNC(C)(C)CC(C)(C)C)cn1 159853052 PTZRUEWHTGAUBE-UHFFFAOYSA-N 263.429 3.452 70 20 CGID CCCc1noc(CCCC(=O)N[C@@H]2CCC[C@@H]2CC)n1 159557046 MRTNTROEYAQGPO-QWHCGFSZSA-N 293.411 3.040 70 20 CGID COc1ccc(NC(=O)N(C)c2ccccc2)cc1OC 217267387 ZMWXUMTYZKRBRK-UHFFFAOYSA-N 286.331 3.372 70 20 CGID CC[C@H](C)CN(CC)Cc1nc(N)c2ccccc2n1 160567830 TXPSMUYHGOWCHJ-LBPRGKRZSA-N 272.396 3.080 70 20 CGID CC[C@@H](C)N(C)CCNCc1cccc2cccnc12 217395724 XUYRRUXOEZLFJZ-CQSZACIVSA-N 271.408 3.055 70 20 CGID CCOC(=O)[C@H](N[C@H]1CCC(C)(C)C1)c1ccccc1 218749828 BVAUUQGYHPHTNH-LSDHHAIUSA-N 275.392 3.459 70 20 CGID Cc1ccoc1C(=O)NCCCN[C@H](C)c1ccccc1 161215242 CKLZIGACMRRGIQ-CQSZACIVSA-N 286.375 3.059 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1c(C)noc1C 161244093 JZYBEMURUIQGEO-CHWSQXEVSA-N 264.369 3.332 70 20 CGID CO[C@]1(C)C[C@@H](N(C)C(=O)Nc2ccc(C)nc2)C1(C)C 161324065 VBKWTVUYWHGNIH-CZUORRHYSA-N 291.395 3.057 70 20 CGID Cc1cc(C(=O)Nc2cccc(OC3CCCC3)c2)ncn1 161461145 UWAFVKSYRAVITD-UHFFFAOYSA-N 297.358 3.359 70 20 CGID COCCC(=O)Nc1c(C)cc(C)cc1Br 160015850 VYRVMVZHCIZZHJ-UHFFFAOYSA-N 286.169 3.041 70 20 CGID CCC(CC)(CC)CNC(=O)N1CCOC(C)(C)C1 160079749 YIDVJQNHAQRMGA-UHFFFAOYSA-N 270.417 3.023 70 20 CGID C[C@@H]1CCN(C(=O)Nc2ccc(N(C)C)nc2)C[C@H](C)C1 160083534 CZOARFVNCLZDTR-CHWSQXEVSA-N 290.411 3.048 70 20 CGID COC[C@H](Cc1ccccc1)N[C@@H](C)c1ccco1 160196681 PSYFVYHHRYWTNH-ZFWWWQNUSA-N 259.349 3.188 70 20 CGID CCc1ccc([C@H](CC)N[C@H](CCO)CSC)cc1 160258814 GNGRHKIVAAAPLY-CVEARBPZSA-N 281.465 3.404 70 20 CGID CCCCn1ncc(NC(=O)N2CCC[C@@H]2C)c1C 160260254 HHNPNLJVMUNKEV-NSHDSACASA-N 264.373 3.008 70 20 CGID FC(F)(F)c1ccc(N[C@@H]2CCO[C@H](C3CC3)C2)nc1 160307797 VLXYFIDOSZJNRK-NEPJUHHUSA-N 286.297 3.470 70 20 CGID CCCN1CCCN(C(=O)c2ccc(Cl)cc2F)CC1 160361540 MNUWYYVORFQIMV-UHFFFAOYSA-N 298.789 3.037 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)c1nc2ccccc2c(=O)[nH]1 160527247 NVLLLRQATRQASO-STQMWFEESA-N 287.407 3.352 70 20 CGID CC1(C)CCCC[C@H]1Nc1cc(=O)n2ccccc2n1 160712438 LGLLIKKFQFMJDT-GFCCVEGCSA-N 271.364 3.075 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(F)c(NC(C)=O)c1 160840632 UIYDUMRSQZCKBN-XHDPSFHLSA-N 278.327 3.159 70 20 CGID COc1ccc(N(C)C(=O)Cc2cccs2)cc1F 159601525 RUAVQCGJNRGILS-UHFFFAOYSA-N 279.336 3.101 70 20 CGID CN1[C@H]2CC[C@H]1CN(C(=O)CC1CCC(C)(C)CC1)CC2 159454324 GDCQEOLQJUHZEV-HOTGVXAUSA-N 292.467 3.288 70 20 CGID Cc1cc(NC(=O)[C@@H](C)c2ccc(Cl)s2)c[nH]c1=O 159484609 QVSQNQSYSZGAEP-QMMMGPOBSA-N 296.779 3.140 70 20 CGID CC(C)(C)CCC(=O)N[C@@H]1CCOC2(CCCC2)C1 159888155 OTSDKTYBCNORIH-CYBMUJFWSA-N 267.413 3.421 70 20 CGID Cc1noc(C)c1[C@H](C)CNC(=O)NCC1(C(C)C)CC1 159557573 JWQWXGPBZADPPI-LLVKDONJSA-N 293.411 3.130 70 20 CGID CC(C)Oc1ccccc1CSCCN1CCOCC1 159777158 BMINQSGOKXHMPE-UHFFFAOYSA-N 295.448 3.039 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2c(C)noc2C)n1 159739799 BUBWQWNYFRXBEA-INIZCTEOSA-N 271.364 3.332 70 20 CGID O=C(OCCCN1CCCCC1)c1c[nH]c2ccccc12 216634578 VRTANNQHTRKUJV-UHFFFAOYSA-N 286.375 3.201 70 20 CGID COc1ccc(CN(C)Cc2cccnc2C)cc1 159869643 NVFHMYZDTHNSNR-UHFFFAOYSA-N 256.349 3.031 70 20 CGID CC(C)CC[C@@H](C)NC(=O)c1ccnc(Cl)c1F 161287014 CXIGRMNUCPEHKI-SECBINFHSA-N 272.751 3.429 70 20 CGID Cc1ncsc1C(=O)N[C@@H]1CCCc2sccc21 160024313 AAFDQPDHBYKBFX-SNVBAGLBSA-N 278.402 3.320 70 20 CGID CCCc1ccc([C@@H](C)N[C@@H](CCO)CSC)cc1 160251907 KZJXDDJRNJNGKW-CJNGLKHVSA-N 281.465 3.404 70 20 CGID CC[C@@H]1CCCN(C(C)(C)CN[C@@H](C)C2CCOCC2)C1 161026757 LOMOWIFEAYZLBE-JKSUJKDBSA-N 296.499 3.292 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H](C)c1ccccc1OC 161175181 DZCYQBASBWAJEX-LSDHHAIUSA-N 276.424 3.220 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)N[C@H](C)CC(C)C 161297341 YUIFKIDNHGJXNA-WDEREUQCSA-N 266.385 3.336 70 20 CGID CC[C@@H](SCC(=O)NC1CC1)c1ccc(F)cc1F 161366473 QYCVSIZKHHYLRT-CYBMUJFWSA-N 285.359 3.428 70 20 CGID O=C(CC1CC1)N1CC[C@@H](Oc2ccccc2Cl)C1 161376604 GVBJXBYVLITCSM-GFCCVEGCSA-N 279.767 3.120 70 20 CGID Cc1cccc(C(=O)Nc2ccc3nccnc3c2)c1F 161465881 BNSWFYVMQGYGMY-UHFFFAOYSA-N 281.290 3.330 70 20 CGID CC[C@H](NCCC1CCN(CC(F)(F)F)CC1)C1CC1 160036497 GBYKQMUPMINFLI-AWEZNQCLSA-N 292.389 3.429 70 20 CGID CC[C@@H](C)N(Cc1ccccc1)C(=O)[C@@H]1CCCCO1 160055271 WLMIMYCCVXTGAC-ZBFHGGJFSA-N 275.392 3.383 70 20 CGID CC(C)[C@H](NC(=O)N[C@@H](C)CCO)c1ccccc1Cl 160090794 GVYGXJPZFDAFIF-FZMZJTMJSA-N 298.814 3.107 70 20 CGID CS[C@H](C)CC(=O)N[C@H](C)Cc1ccccc1C 160324638 ONRAXUINGGBWJV-CHWSQXEVSA-N 265.422 3.184 70 20 CGID CC(C)(C)c1nnc(N[C@@H]2CCO[C@@H](C3CC3)C2)s1 160472975 NHNPGHWJQWFJBF-GHMZBOCLSA-N 281.425 3.205 70 20 CGID Cc1cc(C(=O)N(C)[C@H](C)CO)c(C)n1C1CCCCC1 160548509 COXLBXBVFFLETM-CYBMUJFWSA-N 292.423 3.063 70 20 CGID C[C@@H](N[C@@H](CCCO)c1ccccc1)c1cncs1 160751969 BAGDKMHAHUFTMW-OCCSQVGLSA-N 276.405 3.308 70 20 CGID OCC[C@@H](N[C@@H]1CCc2ccccc2C1)c1ccccc1 160981479 SVJDKUTVUUXRJH-RTBURBONSA-N 281.399 3.257 70 20 CGID O=C(CSC(F)(F)F)N[C@H]1CCCc2sccc21 159897828 KWATZBWRKXMJQJ-QMMMGPOBSA-N 295.351 3.495 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1 159919270 UFYXFMDTNPQFAM-AWEZNQCLSA-N 277.339 3.047 70 20 CGID CC1(C)CC[C@H](COC(=O)c2ccc(N)cc2Cl)O1 160777088 BWXRWONZVKJEEN-SNVBAGLBSA-N 283.755 3.037 70 20 CGID COc1ccc(C(=O)N[C@H](C)CCc2ccco2)c(F)c1 218440737 GRHMFPWLECBPDV-LLVKDONJSA-N 291.322 3.178 70 20 CGID CC[C@H](CSC)N(C)Cc1nc2ccccc2[nH]1 161400813 LRGQRSBVLZNYMK-LLVKDONJSA-N 263.410 3.136 70 20 CGID CC[C@H](C)N(C)CCNCc1ccc(OC(C)C)cc1 217389453 WMDUZPNULQCJFZ-HNNXBMFYSA-N 278.440 3.294 70 20 CGID C[C@H]1CCC[C@@H](CNC(=O)c2[nH]nc3ccccc23)C1 218009144 VWRMEIBSRRUEPD-NWDGAFQWSA-N 271.364 3.119 70 20 CGID Cc1cccc(C)c1NC(=O)NCCCC(=O)OC(C)C 161066001 MOISYRSSCQNJGH-UHFFFAOYSA-N 292.379 3.157 70 20 CGID O=C(Nc1ccncc1)N[C@H]1CCCc2sccc21 161182333 QSMPQRRDNKTCNX-LBPRGKRZSA-N 273.361 3.342 70 20 CGID CCC[C@H]1CCCN(C(=O)C[C@H](C)C2CCNCC2)C1 161447818 REJBWALWJCFWFB-GJZGRUSLSA-N 280.456 3.051 70 20 CGID Cc1ccc(NC(=O)NCc2ccc(C)s2)cn1 161499304 ZEEVQESEIWIDTN-UHFFFAOYSA-N 261.350 3.082 70 20 CGID CCc1ccc([C@@H](C)NC[C@@](C)(O)c2ccsc2)o1 160136924 KDJNLKJCEMDYQD-IAQYHMDHSA-N 279.405 3.462 70 20 CGID C[C@@H]1CC(NC(=O)Nc2ccc3[nH]ccc3c2)C[C@@H](C)O1 160169899 UOMQBZLUKAPAGB-GHMZBOCLSA-N 287.363 3.245 70 20 CGID Cc1cccc([C@H]2CCCN2C(=O)CC2(N)CCC2)c1C 160723700 FBSTWVFVGWREOV-MRXNPFEDSA-N 286.419 3.238 70 20 CGID Cc1ccc(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)cc1F 160856940 FQUALPPBLZOBFR-AWEZNQCLSA-N 296.386 3.299 70 20 CGID CC[C@@H](NCCOC[C@@H]1CCCO1)c1ccc(F)cc1F 160931228 LOFGHUJZBDEBGO-XJKSGUPXSA-N 299.361 3.201 70 20 CGID Cc1[nH]ccc1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 159456174 KHBXRVWSGAKNGK-PBHICJAKSA-N 298.386 3.221 70 20 CGID Cc1nc2cc(NC(=O)c3cc(C(C)C)on3)ccc2n1C 159687542 YSJRRWUCHRVKCZ-UHFFFAOYSA-N 298.346 3.245 70 20 CGID Cc1[nH]c2ccc(C(=O)Nc3c[nH]c(=O)c(C)c3)cc2c1C 159505446 DKJZAMJFGABLQT-UHFFFAOYSA-N 295.342 3.034 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)CSCc1cccnc1 159514133 YJYNMLBQIKGULS-ZIAGYGMSSA-N 278.421 3.010 70 20 CGID CO[C@@H](C)CC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 159917454 CROQVEVUUHTREV-KBXCAEBGSA-N 298.386 3.021 70 20 CGID C[C@H](C(=O)Nc1cccc([S@@](C)=O)c1)c1cccs1 159739346 XLJFQAHMMKGORK-OVWNDWIMSA-N 293.413 3.228 70 20 CGID CC(C)Sc1ccccc1NC(=O)C[C@@H]1COC(=O)C1 159566119 DEUBDPTZYUNCIX-NSHDSACASA-N 293.388 3.079 70 20 CGID CCC(CC)(CCO)CNc1nc(C(C)(C)C)ns1 159782919 CZPMBBOSOQVIFY-UHFFFAOYSA-N 285.457 3.436 70 20 CGID CCC(C)(C)C(=O)N(C)CCOCc1ccccc1 159512783 BPNOROKMXGTRJQ-UHFFFAOYSA-N 263.381 3.098 70 20 CGID Cc1ccc(CCNC(=O)NCCc2ccc(C)cc2)cc1 217307949 ZCGYYXALUDNWNO-UHFFFAOYSA-N 296.414 3.388 70 20 CGID C[C@@H](CO)SCc1cc(F)cc(Br)c1 160813986 UXFAHYWYXDCDCB-ZETCQYMHSA-N 279.174 3.202 70 20 CGID COc1ccc(Cn2nc(C3CC3)nc2C2CC2)cc1F 161481840 PRNFQGOUICXBIE-UHFFFAOYSA-N 287.338 3.229 70 20 CGID CCC(CC)NC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 160109356 HDPDLZQSBPMUHA-HNNXBMFYSA-N 292.379 3.164 70 20 CGID CC[C@@H](NC(=O)C1(CCOC)CCC1)c1c(C)noc1C 160269895 RXALEINIHWSWAX-CYBMUJFWSA-N 294.395 3.066 70 20 CGID O=C(N[C@H]1CCSc2ccc(F)cc21)[C@@H]1CCCCO1 160290670 RDFYBCDABKCHLD-STQMWFEESA-N 295.379 3.048 70 20 CGID C[C@H]1CC[C@H](CC(=O)Nc2ccnn2C(C)(C)C)C1 160581703 ZFQNSPMAVSXGOK-RYUDHWBXSA-N 263.385 3.403 70 20 CGID Cc1cccnc1NC(=O)c1cc(F)cc2cccnc12 160745568 CZEXYOPZWXQMGC-UHFFFAOYSA-N 281.290 3.330 70 20 CGID Cc1cccc(C(=O)N[C@H](C)CC(=O)c2cccs2)c1 160862311 XIVJVQXNWNSIFC-GFCCVEGCSA-N 287.384 3.448 70 20 CGID CCc1nnc(COc2ccc(OC)c3ccccc23)o1 160912981 YGALBPVITHWCRR-UHFFFAOYSA-N 284.315 3.373 70 20 CGID Cc1nnc([C@@H](C)N[C@@H](C)c2cccc(F)c2F)o1 159404742 BAKURZYXSLMGJA-JGVFFNPUSA-N 267.279 3.068 70 20 CGID CC(C)(CNC(=O)Nc1nccs1)C1CCCC1 159807547 MAIWCXFRINJAKH-UHFFFAOYSA-N 267.398 3.481 70 20 CGID CCN(Cc1c(C)nc2ccccn12)CC(F)(F)F 159863814 IQTQYHHSJVEWFN-UHFFFAOYSA-N 271.286 3.027 70 20 CGID O=C(CC1CCOCC1)N[C@@H]1CCCc2sccc21 159941221 RSBADLSQRVECHL-CYBMUJFWSA-N 279.405 3.058 70 20 CGID CCSCC[C@@H](C)N(C)C(=O)c1cccc2[nH]cnc12 159765673 IWXMYLLZDNOBHW-LLVKDONJSA-N 291.420 3.167 70 20 CGID C[C@H](NC(=O)C(F)F)c1ccc2c(c1)CCCC2 218686291 IWVVYFIWUHKEFP-VIFPVBQESA-N 253.292 3.008 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1ccccc1C 160014676 CBTRCMPTPVYTJA-INIZCTEOSA-N 281.355 3.421 70 20 CGID CCCSCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160111517 NARMFPYTLFTHOR-NSHDSACASA-N 293.310 3.371 70 20 CGID C[C@@H]1CN(C(=O)NC(C)(C)C)C[C@H](c2ccsc2)O1 160185755 IJBPNEBROGIURX-ZYHUDNBSSA-N 282.409 3.018 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccn(-c2ccccc2)n1 160838810 MVASWRCLUPLMIV-BBRMVZONSA-N 269.348 3.247 70 20 CGID Cc1ncsc1C(=O)N[C@H]1CCOC2(CCCCC2)C1 160980732 VJRJKHCDWFSUNZ-LBPRGKRZSA-N 294.420 3.063 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(Cl)o2)cc1F 159415070 AHGBQCURVZDWBR-UHFFFAOYSA-N 283.686 3.357 70 20 CGID Cc1cccc(OC(F)F)c1NC(=O)NC1CC=CC1 159921137 LPOCXLPPTVZTIE-UHFFFAOYSA-N 282.290 3.437 70 20 CGID Cc1cccc2c(CCC(=O)Nc3ccccn3)c[nH]c12 159542427 JYLOJFKDTZUHMM-UHFFFAOYSA-N 279.343 3.443 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)N1CCC[C@@H]1Cc1ccccc1 159547040 WZJJXVGYRKNEHF-LESCRADOSA-N 299.414 3.225 70 20 CGID Cc1cnc([C@@H](C)NC(=O)NCC2(C3CC3)CCC2)s1 159398560 XIJUTVOKEOBEHQ-LLVKDONJSA-N 293.436 3.392 70 20 CGID CCSCC[C@@H](C)NC[C@H](O)c1c(F)cccc1F 160086130 LPZMHZFVSOGJOB-MFKMUULPSA-N 289.391 3.120 70 20 CGID COC(C)(C)CNCc1ccc(F)c(C(F)(F)F)c1 160154466 XEYYVQMBBGZIMX-UHFFFAOYSA-N 279.277 3.359 70 20 CGID CCCC[C@H](CN)NC(=O)c1cc2ccc(F)cc2s1 161215269 UGFBNZBKZKGJCW-GFCCVEGCSA-N 294.395 3.288 70 20 CGID CCCn1c(CNC[C@@](C)(O)CCC)nc2ccccc21 217805306 LIRNKJXDFIYWBP-KRWDZBQOSA-N 289.423 3.087 70 20 CGID Cn1c(NCC2CCSCC2)nc2ccccc21 161084871 XIRCDIBHGWKUQD-UHFFFAOYSA-N 261.394 3.128 70 20 CGID CC[C@@H](C)CN(C)C(=O)Nc1ccn(CCC(C)C)n1 161506076 LQXHPWXLZDKJIN-CYBMUJFWSA-N 280.416 3.439 70 20 CGID CC(C)C[C@H](C)CC(=O)N(C)c1ccc2c(c1)OCO2 160221698 JAAMMNYTBOZXQQ-LBPRGKRZSA-N 277.364 3.450 70 20 CGID Cc1cc(C(=O)Nc2cc(-c3ccccc3)ns2)ncn1 160460863 IJBKVBLFXUQQOF-UHFFFAOYSA-N 296.355 3.161 70 20 CGID CCCC1(CNC(=O)[C@@H](C)OCCC(C)C)CC1 160562245 QZXJFUHMLLNSOT-CYBMUJFWSA-N 255.402 3.134 70 20 CGID Cc1ccc(C(C)(C)CC(=O)N[C@H](CO)CC(C)C)cc1 160881494 QJAYGIWUNGLEFV-INIZCTEOSA-N 291.435 3.186 70 20 CGID C[C@H](c1nc([C@H]2CCOC2)no1)c1c(F)cccc1F 160888851 PUMGLZKWTWVOFZ-IUCAKERBSA-N 280.274 3.004 70 20 CGID COCC(C)(C)C(=O)N[C@H]1CCSc2ccc(F)cc21 160891747 IXISWDACSWDZHQ-LBPRGKRZSA-N 297.395 3.151 70 20 CGID Cc1nc2ccccn2c1CN1C[C@H](C)CC[C@@H]1C 160898383 PYVQBHRPXWIPKT-OLZOCXBDSA-N 257.381 3.263 70 20 CGID COc1ccc(OC)c(NC(=O)N[C@@H](C)C2CCC2)c1 159416464 WTPPRQPKQSUNPA-JTQLQIEISA-N 278.352 3.014 70 20 CGID Cc1ccccc1[C@H](NC(=O)[C@H](C)N)[C@@H]1CCC[C@H](C)C1 159686400 FOTRFUYDDSBBKO-MKVSYHDVSA-N 288.435 3.326 70 20 CGID CC[C@@H](NC(=O)Nc1ccnc(C)c1Cl)[C@H]1CCCO1 159943091 SASOHPKFPNMZON-ZYHUDNBSSA-N 297.786 3.123 70 20 CGID COc1ccc(N(C)C(=O)CCc2ccccc2)cc1F 159799257 HBUBFBIHQZXMFP-UHFFFAOYSA-N 287.334 3.430 70 20 CGID Cc1cc(C)cc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159607864 PKMXEMGIWXPADF-ZACQAIPSSA-N 271.404 3.351 70 20 CGID CCCCC1CCC(C(=O)N(C)[C@H](CN)C2CC2)CC1 159784681 KELOIDBFZSGMCA-AVVWSFFYSA-N 280.456 3.179 70 20 CGID CC[C@@H](NCCCc1cnn(C)c1)c1ccc(F)cc1 160868424 HGMKREJOFSJIFA-MRXNPFEDSA-N 275.371 3.233 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cc(F)ccc1F 161019979 HASNSYCWBQBDHU-UBHSHLNASA-N 282.378 3.488 70 20 CGID CC[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccccc1OC 218118096 AGSATQVYNNLVHQ-ULQDDVLXSA-N 288.435 3.363 70 20 CGID C[C@H]1CN(Cc2csc(C3CC3)n2)CC(C)(C)O1 161468044 MJSZQTBQUDTWNU-JTQLQIEISA-N 266.410 3.020 70 20 CGID CC[C@H](C)OCC(=O)N1CCC[C@H]1C1CCCCC1 159451315 VOIZVERIBQZIOK-ZFWWWQNUSA-N 267.413 3.373 70 20 CGID CCO[C@H]1C[C@H](NCC2(CO)CCCC2)C12CCCCC2 160100891 RFFKCYZCHQYASM-HOTGVXAUSA-N 295.467 3.257 70 20 CGID CC(C)c1noc(NC[C@](C)(O)c2ccccc2Cl)n1 160186733 LHMWCTOYQRSUQR-AWEZNQCLSA-N 295.770 3.166 70 20 CGID Cc1ccc(-c2nnc(NC(=O)[C@H]3CCC[C@@H](C)C3)[nH]2)o1 160259258 IIVOVBDLPULBPL-KOLCDFICSA-N 288.351 3.138 70 20 CGID COCCC1(CNC(=O)N[C@H](C)CC(C)C)CCCC1 160366450 NBQYZWOXSITEJY-CQSZACIVSA-N 284.444 3.317 70 20 CGID CC(C)=C[C@H]1[C@@H](C(=O)N(C)Cc2cccn2C)C1(C)C 160454807 MZAHVYGMNDFBBU-GJZGRUSLSA-N 274.408 3.222 70 20 CGID CC[C@@H](NC(=O)Cc1cccc(F)c1)c1c(C)noc1C 160493659 WMSQIYVLGQZXJG-CQSZACIVSA-N 290.338 3.241 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](C)C2CCCC2)c1 160632534 HMYXBJOTDBMGRW-CQSZACIVSA-N 288.435 3.495 70 20 CGID COCC[C@H](C)NCc1ccnc(O[C@H](C)CC(C)C)c1 160832317 KJKLANFKLJJFED-LSDHHAIUSA-N 294.439 3.410 70 20 CGID CC(C)n1cc([C@H](C)NC2CC(C)(C)NC(C)(C)C2)cn1 159633870 CLVXDNKQBNQJFG-ZDUSSCGKSA-N 292.471 3.424 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)Cc1ccc(O)cc1Cl 159498096 DJXSCBZMUBNEDG-YGRLFVJLSA-N 281.783 3.283 70 20 CGID CSCCc1ccc(NC(=O)NOCC(C)C)cc1 159946439 WYNGAOJDOGSXSA-UHFFFAOYSA-N 282.409 3.301 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1cccc2c1CCC2 159987482 FSNPXMWUVYDPEW-HNNXBMFYSA-N 299.414 3.397 70 20 CGID O=S(=O)(Cl)C(Cc1ccccc1)Cc1ccccc1 103472922 PTKRUCHXVXUPMM-UHFFFAOYSA-N 294.803 3.409 70 20 CGID COC(=O)c1ccc(C)c(NC(=O)c2cccc(C)c2O)c1 218332506 AQZBEKRZLMOQJW-UHFFFAOYSA-N 299.326 3.048 70 20 CGID Clc1ccccc1[C@@H]1CN(CCOCC2CC2)CCO1 160559550 SZUJJPMKKHOIBZ-INIZCTEOSA-N 295.810 3.140 70 20 CGID CC[C@H]1CCCC[C@@H]1NCc1cccc(C(=O)N(C)C)c1 161410279 GPWUUNNEPQUKNL-RDJZCZTQSA-N 288.435 3.447 70 20 CGID CCOc1cccc(NC(=O)N[C@@H](CC)[C@@H]2CCCO2)c1 161416854 MCQRDZSSBIAIQS-GJZGRUSLSA-N 292.379 3.164 70 20 CGID CCOCCC1(C(=O)N[C@@H]2CCCc3occc32)CCC1 161498519 DBODLEMANFVISF-CQSZACIVSA-N 291.391 3.370 70 20 CGID CCc1nc2cc(NC(=O)C[C@H](C)SC)ccc2o1 160377967 STNIFRGFIOWDIO-VIFPVBQESA-N 278.377 3.470 70 20 CGID CCCC1(CNC(=O)C[C@@H](C)c2ccncc2)CC1 160721868 PAMHSGWLNHCFEM-CYBMUJFWSA-N 260.381 3.272 70 20 CGID FC(F)(F)c1cccnc1N1CCC[C@@H](c2ccn[nH]2)C1 160798600 FGKNGDIHCUWCDU-SNVBAGLBSA-N 296.296 3.208 70 20 CGID Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(N)=O)s2)cc1 160800088 IKTDULBIYCBLTA-NSHDSACASA-N 289.404 3.498 70 20 CGID Cc1cc(N(C)C)ccc1NC(=O)N(C)[C@@H]1CCSC1 160818540 BTAYEVZWXQLELI-CYBMUJFWSA-N 293.436 3.030 70 20 CGID CC(C)n1cccc1C(=O)NC[C@@H](c1ccccc1)N(C)C 160923003 JLOOFEZIBVNLDJ-KRWDZBQOSA-N 299.418 3.102 70 20 CGID Cc1cc(NC(=O)c2csc3ccccc23)c[nH]c1=O 159519850 WMHOJPKMXPNVIE-UHFFFAOYSA-N 284.340 3.150 70 20 CGID Cc1cc(C(=O)OCc2nc(C)sc2C)cc(Cl)n1 159771404 BOJRIAZXKJTHHC-UHFFFAOYSA-N 296.779 3.474 70 20 CGID CC[C@@H](O)CCNCc1ccc(F)c(C(F)(F)F)c1 160159138 PFHQULVSCTVCCW-SNVBAGLBSA-N 279.277 3.095 70 20 CGID CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)NCC2CCOCC2)C1 218712872 VEMKPMMTWJILHH-WMLDXEAASA-N 294.439 3.023 70 20 CGID CCC[C@@H](COC(C)(C)CC)CS(=O)(=O)Cl 114476604 LFHRFIROMTXJRS-JTQLQIEISA-N 270.822 3.177 70 20 CGID Cc1ccccc1[C@@H](C)SCc1nnnn1C1CC1 161210221 HECMCOIYQCNFPZ-LLVKDONJSA-N 274.393 3.311 70 20 CGID Cc1cnccc1CCNC(=O)N[C@@H]1CC[C@H](C)C[C@@H]1C 161214492 ICDYNLCOFBIQTJ-HEHGZKQESA-N 289.423 3.056 70 20 CGID CC(C)(C)c1cnc([S@](=O)C[C@@H]2CCCCO2)s1 160453113 KETRRTGLQCXMAF-YPMLDQLKSA-N 287.450 3.117 70 20 CGID Cc1csc(CCCCN[C@@H]2C[C@@H](C)N(C)C[C@@H]2C)n1 160668149 TWJWHUUWELFZTQ-NWANDNLSSA-N 295.496 3.093 70 20 CGID CC1(C)CCCC[C@@H]1CC(=O)N1CCOCC1(C)C 160959334 SUPAQSRKGPGTHC-CYBMUJFWSA-N 267.413 3.230 70 20 CGID C[C@@H](Oc1ccc(Cc2ccccc2)cc1)C(=O)NC1CC1 159429345 USFGGPYQTQHBOP-CQSZACIVSA-N 295.382 3.323 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1[nH]c(C)cc1C 159384762 LTGLILOBTSCKEA-CQSZACIVSA-N 284.359 3.057 70 20 CGID Cc1noc(C)c1CCS(=O)(=O)[C@H](C)c1ccccc1 159571826 WIDQMPZCCWKBLL-CYBMUJFWSA-N 293.388 3.010 70 20 CGID CCCN1CCC(NCc2c(C)cccc2C)CC1 160381853 ZETWCXSVWSUXGS-UHFFFAOYSA-N 260.425 3.267 70 20 CGID Fc1cccc(Br)c1CNCC(F)(F)F 160260493 VDOZTGMPPIZMQU-UHFFFAOYSA-N 286.066 3.240 70 20 CGID C[C@H](CC(C)(C)c1ccccc1)S(=O)(=O)Cl 103915937 NUIHPTPOTQYLDK-SNVBAGLBSA-N 260.786 3.311 70 20 CGID Cc1cscc1C(=O)N(C)c1ccc2c(c1)OCO2 160186934 MNFCKYBLKVMWEF-UHFFFAOYSA-N 275.329 3.062 70 20 CGID C[C@H](C1CC1)N(C)C[C@@H](O)c1cc2ccccc2o1 216925658 VHUKXFVPOXOOQG-BXUZGUMPSA-N 259.349 3.197 70 20 CGID C[C@@H](OC(=O)c1cc(F)cc(N)c1F)c1ccccc1 217925503 HAQNBEOFPQDNEQ-SECBINFHSA-N 277.270 3.465 70 20 CGID CCOc1cc(C)ccc1NC(=O)NC[C@H](C)SC 161075212 OBKCRERCPPBJJI-NSHDSACASA-N 282.409 3.267 70 20 CGID CS[C@@H](C)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 161338637 GWOKMUVICQSLNY-WDEREUQCSA-N 299.823 3.071 70 20 CGID Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3)C2)cn1 161366614 KCEHSOACTMRTLF-HNNXBMFYSA-N 281.359 3.411 70 20 CGID Cc1cccc(C(=O)NCCN(C)c2ccccc2)c1F 161423659 ZJZUHUWFVRQXIU-UHFFFAOYSA-N 286.350 3.000 70 20 CGID CC1=NN(c2ccc(C(=O)N3[C@H](C)CC[C@H]3C)cc2)CC1 161477707 RCCQLUBXTIYHOI-ZIAGYGMSSA-N 285.391 3.286 70 20 CGID O=C(CCCc1ccccc1)NCCc1cccc(O)c1 160201495 FDOCUWUIBRKQTD-UHFFFAOYSA-N 283.371 3.074 70 20 CGID CC(C)[C@H](C)NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 160375046 RBSLJXBQJDIUHX-SWLSCSKDSA-N 292.379 3.020 70 20 CGID COc1ccc(NC(=O)NCC2(C3CC3)CC2)cc1F 160560053 HFIXUWIKULFMGK-UHFFFAOYSA-N 278.327 3.146 70 20 CGID CCCCN(CC)C(=O)C1(CCOCC)CCC1 160952960 BJRJJTYPCIQFDE-UHFFFAOYSA-N 255.402 3.232 70 20 CGID O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1cc(F)ccc1F 159664586 IHFQEPQXXKDXNM-NHYWBVRUSA-N 294.345 3.168 70 20 CGID Cc1cc(NC(=O)c2cccc(Cl)c2Cl)c[nH]c1=O 159689798 XEFSIMQEWPUXGU-UHFFFAOYSA-N 297.141 3.242 70 20 CGID C[C@H](NCCc1ccc(Cl)nc1)c1ccccn1 159377280 UCBLYRJPGTVDDL-NSHDSACASA-N 261.756 3.023 70 20 CGID CCCC[C@@H](Nc1cc(C)ncn1)C(=O)OC(C)(C)C 159974344 HPJSLZBPAQPGIU-GFCCVEGCSA-N 279.384 3.097 70 20 CGID COCCCN(C)Cc1cc(Cl)ccc1Cl 159688952 OAVBIMDCFOENRZ-UHFFFAOYSA-N 262.180 3.462 70 20 CGID CCC(CC)(CO)CN[C@H]1CCCc2ccccc21 161338690 VUGYBNGVPJWKBD-INIZCTEOSA-N 261.409 3.452 70 20 CGID CCNCC1CCN(C(=O)[C@@H]2C[C@H]2C2CCCCC2)CC1 161008929 LPFLHDUTRMZDLR-DLBZAZTESA-N 292.467 3.051 70 20 CGID CNC(=O)C(C)(C)CNc1cc2ccccc2c(Cl)n1 161093683 NXKKYFKNPYGGSL-UHFFFAOYSA-N 291.782 3.072 70 20 CGID Cc1cccc(N(CC(=O)N(C)C)Cc2ccccc2)c1 161268322 BTFTVINMUDRPEK-UHFFFAOYSA-N 282.387 3.090 70 20 CGID Cc1cccc(C)c1CSCC(=O)N(C)C1CC1 161382658 VSHPLGUMNJECAJ-UHFFFAOYSA-N 263.406 3.157 70 20 CGID Cc1cccc2ncnc(N[C@H]3CCO[C@@H](C4CC4)C3)c12 160332246 JOLSJNJINRNRCE-DZGCQCFKSA-N 283.375 3.308 70 20 CGID COCCOc1ccc(NC(=O)C[C@H](C)SC)c(C)c1 160372101 VHWDSPNWEZXCIX-LBPRGKRZSA-N 297.420 3.100 70 20 CGID C[C@H](NC(=O)[C@@H]1OCC[C@@H]1C)[C@@H](C)C1CCCCC1 160956783 ADQYIFFKTMSPOE-SFDCQRBFSA-N 267.413 3.133 70 20 CGID NCCC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 160982044 VBJKNBZLTUWLNG-AWEZNQCLSA-N 280.799 3.133 70 20 CGID CC(C)c1cc(NC(=O)COC/C=C/c2ccccc2)[nH]n1 159662930 SARIYXRNMFUXMS-RMKNXTFCSA-N 299.374 3.202 70 20 CGID CC(C)(C)c1nsc(Nc2ccc3c(c2)CC(=O)N3)n1 159477748 VAWYAAMOVLXIDB-UHFFFAOYSA-N 288.376 3.074 70 20 CGID CO[C@H]1CCCC[C@@H]1Nc1nc(C(C)(C)C)ns1 159674717 IJIAYVAGJAGLRO-UWVGGRQHSA-N 269.414 3.205 70 20 CGID COc1ccc(SCC(=O)NCC2(C3CC3)CC2)cc1 159743069 KAOVFWJUWGZUNE-UHFFFAOYSA-N 291.416 3.094 70 20 CGID C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1C=CCCC1 159790287 HAWSPGXVMSZQNE-UKRRQHHQSA-N 288.391 3.073 70 20 CGID COc1ccc([C@@H](C)NCC2(CO)CCCC2)cc1F 160120329 FYALEOVYTAAYOR-GFCCVEGCSA-N 281.371 3.038 70 20 CGID CC(C)Sc1ccccc1NC(=O)[C@@H]1CCCNC1 161398507 JQNOAYUXDFYZHW-GFCCVEGCSA-N 278.421 3.125 70 20 CGID CC[C@@H](SC)c1nc(-c2ccc(C(=O)OC)cc2)no1 161333525 XZNJPAGFXBHUGY-LLVKDONJSA-N 292.360 3.337 70 20 CGID C[C@H]1CCN(C(=O)Nc2cccnc2Cl)C[C@H]1C 160007123 GTZMWRQEDWUEMA-VHSXEESVSA-N 267.760 3.245 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCCCN(C)Cc1ccccc1 160165821 NBCCMSJCMOHLHE-SJLPKXTDSA-N 288.435 3.061 70 20 CGID CCSCc1cccc(NC(=O)[C@@H]2CCCCN2)c1 160423762 IMHJLALADKDRSP-AWEZNQCLSA-N 278.421 3.020 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](CC)C2CC2)c1 160635273 HTKVQZMFZTXKSH-INIZCTEOSA-N 274.408 3.105 70 20 CGID CCCc1csc(-c2cccc(-c3nnc(N)o3)c2)n1 160644076 UQXBDKKXGPFTHU-UHFFFAOYSA-N 286.360 3.395 70 20 CGID CCC(=O)c1cccc(NC(=O)c2ccc3[nH]ncc3c2)c1 160722152 RDMNDYMUIYLXNH-UHFFFAOYSA-N 293.326 3.408 70 20 CGID CCc1nnc(NC(=O)C(C)(C)C2CCCC2)s1 160746879 CWOVQHHYIAKSIM-UHFFFAOYSA-N 267.398 3.255 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2c(C)nn(C)c2C)n1 159843189 OJNYJYYGZWTUBJ-KRWDZBQOSA-N 284.407 3.077 70 20 CGID CCCCc1nc(CN(C)C[C@@H]2CCC[C@@H]2O)cs1 159652263 IKKANQWPSRKAKS-JSGCOSHPSA-N 282.453 3.079 70 20 CGID O=C(CC1CCSCC1)N[C@H]1CCOC2(CCCC2)C1 159664339 KNZGWQJFGSKPKK-AWEZNQCLSA-N 297.464 3.128 70 20 CGID CC(C)N(CCn1ccnc1)Cc1cccc(Cl)c1 159750015 HRTARPALHGGDNT-UHFFFAOYSA-N 277.799 3.447 70 20 CGID Fc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1F 159514102 JJMIWIWAGURYAO-GLQYFDAESA-N 279.330 3.012 70 20 CGID Cc1cccc([C@@H]2CCCN2C[C@@H]2CCCCO2)n1 159826901 GWOKRMQJMBYQOW-HOCLYGCPSA-N 260.381 3.096 70 20 CGID COc1cc(N[C@H](C)c2cn(C)nc2C)ccc1F 160048120 QAJFVCXSPVZTAW-SECBINFHSA-N 263.316 3.049 70 20 CGID CCc1ccc(OCC(=O)OCCC(C)C)cc1 217481283 XKCWGVRCLMPXDK-UHFFFAOYSA-N 250.338 3.217 70 20 CGID Cc1cccc([C@H](O)Cn2c(C)nc3c2CCCC3)c1 216919634 FBFPUIWYBOLETK-QGZVFWFLSA-N 270.376 3.112 70 20 CGID C[C@@H](c1ccccc1Cl)N(C)C(=O)[C@H]1CCCCO1 161119922 OXWHONRATXTWFU-SMDDNHRTSA-N 281.783 3.429 70 20 CGID Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)CCNC(C)C)C1 161290108 PXTLFUZGHCQTJU-HOTGVXAUSA-N 288.435 3.088 70 20 CGID CCCOc1cc(C)ccc1NC(=O)N[C@@]1(C)CCOC1 161374407 NVPIAOIRSTZRSF-INIZCTEOSA-N 292.379 3.084 70 20 CGID Clc1ccc(Cn2nc(C3CC3)nc2C2CC2)cn1 161479078 JFKAGPYDQQJTJT-UHFFFAOYSA-N 274.755 3.130 70 20 CGID CS[C@H](C)CC(=O)N1CCCc2ccc(F)cc21 160153557 ODDJBECZKAWNGO-SNVBAGLBSA-N 267.369 3.247 70 20 CGID CO[C@@H](C)CCC(=O)N[C@@H]1CCCc2sccc21 160163019 NSGFRDWFYPTBKA-CMPLNLGQSA-N 267.394 3.057 70 20 CGID CC1(NC(=O)NCCc2c[nH]c3cc(F)ccc23)CCC1 160331284 NDPZEBDMZGMGKF-UHFFFAOYSA-N 289.354 3.091 70 20 CGID CN(C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)C1CCCCCC1 160630345 PVNLZTVAWMGRBU-ZBFHGGJFSA-N 294.439 3.308 70 20 CGID Cc1ccccc1NC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 160657395 KVOMNYLNNFXBBN-CFVMTHIKSA-N 286.375 3.074 70 20 CGID CC(C)CSCCCNC(=O)CCCc1ccccn1 160669957 DREHNDIAZJKWQB-UHFFFAOYSA-N 294.464 3.300 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CCc1ccc(C(C)C)cc1 160694766 TYKRTZFBKMDPRN-KRWDZBQOSA-N 291.435 3.266 70 20 CGID CCCC(=O)NOCc1ccc(C(F)(F)F)cc1 160699167 IIOMKRSKTPZRIV-UHFFFAOYSA-N 261.243 3.053 70 20 CGID COC[C@H]1CCCN1C(=O)C[C@H]1CCCCC1(C)C 160883340 YLYGIJJFWYQAOZ-ZIAGYGMSSA-N 267.413 3.230 70 20 CGID Cc1ncsc1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160980621 VJRJKHCDWFSUNZ-GFCCVEGCSA-N 294.420 3.063 70 20 CGID COc1ccc(CN(C)Cc2ccc3cn[nH]c3c2)cc1 159853017 GHRKKCKRTDSZHZ-UHFFFAOYSA-N 281.359 3.204 70 20 CGID Cc1cncc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1 159471421 JEOLIICJPCJSCR-QGZVFWFLSA-N 280.371 3.200 70 20 CGID CCc1nc(CNc2nc(C(C)(C)C)ns2)cs1 159386266 GUXUWCSEIPKABR-UHFFFAOYSA-N 282.438 3.467 70 20 CGID CC(C)[C@H]1CCCC[C@H]1NC1CCC2(CC1)OCCO2 160341456 HBERXSCEGNGAET-HZPDHXFCSA-N 281.440 3.477 70 20 CGID COc1cc(NC(=O)c2cc(Cl)ccc2O)ccc1F 160408403 YAZHRUBDVUZEHM-UHFFFAOYSA-N 295.697 3.446 70 20 CGID CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)[C@H](C)CNC 161247646 FHXLJQVYNDMKQC-NVXWUHKLSA-N 290.451 3.020 70 20 CGID CCC(CC)c1cc(C(=O)NCC2(C3CC3)CC2)on1 160027070 JLGYKKHOLOUIFL-UHFFFAOYSA-N 276.380 3.498 70 20 CGID Cc1ccc(CN2CCCc3ccccc3C2)nc1 160069246 KRDFSFONMZEJNG-UHFFFAOYSA-N 252.361 3.338 70 20 CGID CCCCCOCC(=O)N[C@H](CC)c1c(C)noc1C 160298095 WJGKRRTUWZAUCZ-CYBMUJFWSA-N 282.384 3.066 70 20 CGID CCC[C@H](C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160476055 DJQFEOOUMJQFCC-KBPBESRZSA-N 267.413 3.421 70 20 CGID Cc1cc(Oc2ccc(NC(=O)[C@@H](C)C3CC3)cc2)n[nH]1 160506798 AWSIVKOFKNBSFC-NSHDSACASA-N 285.347 3.495 70 20 CGID CC(C)(C)c1nc(CCNC(=O)C2[C@@H]3CCC[C@@H]23)cs1 160653589 YPSOSCZQQMCSSL-VXGBXAGGSA-N 292.448 3.145 70 20 CGID NC(=O)NCc1ccc(Sc2ccccc2)cc1 160876602 PPPQIHZYJPXCLR-UHFFFAOYSA-N 258.346 3.006 70 20 CGID CC[C@H](C)NC(=O)NOCc1ccc(C(F)(F)F)cc1 160977311 HKALDXDVEYXRKO-VIFPVBQESA-N 290.285 3.235 70 20 CGID C[C@@H](NCCO)c1ccc(Oc2ccccc2)c(F)c1 159688338 PHIZKWMFRPHXAB-GFCCVEGCSA-N 275.323 3.261 70 20 CGID CCS[C@@H]1CCC[C@H]1NC(=O)c1ccc(F)c(OC)c1 159702973 YWRGQADRBUCOKF-TZMCWYRMSA-N 297.395 3.238 70 20 CGID Cc1nccc(NC(=O)N(C)C[C@H]2CCCCO2)c1Cl 159708080 YLQPAGVOZIGIBR-LLVKDONJSA-N 297.786 3.076 70 20 CGID CC(C)CCc1nc(CN(C)C[C@@H]2CCC[C@@H]2O)cs1 159766939 ZRYXSXCWRVETGR-ZFWWWQNUSA-N 296.480 3.325 70 20 CGID CC(C)(C)c1nsc(N[C@H]2CCC[C@H]3OCC[C@H]23)n1 159976979 HWWYKFOTAPBLGW-OUAUKWLOSA-N 281.425 3.205 70 20 CGID C[C@@H](CNC[C@H](O)c1ccccc1F)c1ccccc1 159740368 PFESBCYOULJRJY-GUYCJALGSA-N 273.351 3.252 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cc(C)ccc1OC 160092567 YYMGHTFTTKIXJO-CABCVRRESA-N 278.440 3.385 70 20 CGID COc1cc(NC(=S)NC2CCCCC2)ccc1F 160227542 RJURMXMZDSCMPS-UHFFFAOYSA-N 282.384 3.453 70 20 CGID C[C@@H](c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](N)C1 217484441 QZWMWRCQADBGMZ-GXFFZTMASA-N 272.314 3.190 70 20 CGID CC[C@@H](C)NCc1ccccc1I 218500283 ZPSFQHBDHFIRMZ-SECBINFHSA-N 289.160 3.179 70 20 CGID c1cc(CNCCN2CCCCCC2)c2[nH]ccc2c1 218089905 JPAOMSGBMSEYSN-UHFFFAOYSA-N 271.408 3.134 70 20 CGID CC(C)NCCC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 161046691 VPGNHNTWYRTURJ-CZUORRHYSA-N 292.398 3.123 70 20 CGID COC[C@H](NC(=O)CCC(C)(C)c1ccccc1)C1CC1 161254426 WOODAAGQGLMVHU-INIZCTEOSA-N 289.419 3.286 70 20 CGID CCc1cnc(NC(=O)N(Cc2ccccc2)OC)s1 161280884 BBIALHPVRIJYMS-UHFFFAOYSA-N 291.376 3.301 70 20 CGID CC(C)CC(=O)N1CC[C@H](Oc2ccccc2Cl)C1 161448967 LNMVFEPQAJXDFQ-LBPRGKRZSA-N 281.783 3.366 70 20 CGID O=C(COc1ccc2[nH]ccc2c1)N(C1CCCC1)C1CC1 160032269 VINSZGJNGBLKIE-UHFFFAOYSA-N 298.386 3.480 70 20 CGID CC(C)C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccccc1 160103527 NRNXHPAGFNOSEZ-CVEARBPZSA-N 275.392 3.459 70 20 CGID CCc1ccc([C@@H](CO)Nc2ncnc3sccc23)cc1 160903821 XSIHAEJNYKJLFC-CQSZACIVSA-N 299.399 3.399 70 20 CGID CC[C@@H](C(=O)Nc1ccc(OC(C)C)c(C)c1)N(C)C 159812259 ILZOMTIDFBBAKH-AWEZNQCLSA-N 278.396 3.061 70 20 CGID CN1[C@H]2CC[C@H]1CN(C(=O)C[C@@H]1CCCCC1(C)C)CC2 159444246 RZNNDDKSTIOCSQ-JYJNAYRXSA-N 292.467 3.288 70 20 CGID Cc1ccccc1[C@H](NC(=O)[C@@H](C)N)C1CCC(C)CC1 159685957 QGYNQURWIBDXHI-LXDKRTHCSA-N 288.435 3.326 70 20 CGID CC1CCN(c2cccc(NC(=O)Nc3cn[nH]c3)c2)CC1 159696636 ZLAVGCZXZYGWER-UHFFFAOYSA-N 299.378 3.290 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(SC)o2)cc1F 159517200 LRVRCYULMHWSKO-UHFFFAOYSA-N 295.335 3.426 70 20 CGID COCC(C)(C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 159714209 FWTDLNVEQZFWFX-CYBMUJFWSA-N 289.419 3.415 70 20 CGID Cc1ccc(CNC(=O)N2CCC3(CCC3)C2)s1 159969941 LFDUBVDFWSOTKA-UHFFFAOYSA-N 264.394 3.142 70 20 CGID Cc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2O)c1 160399040 BHNVOVLBHOVECC-UHFFFAOYSA-N 297.763 3.155 70 20 CGID O=C(NCCCCc1ccccc1)Nc1ccncc1 217309372 KZEBAKLXOLDUDM-UHFFFAOYSA-N 269.348 3.226 70 20 CGID C[C@H]1CCC[C@H](C)C1NC(=O)c1ccc(Cl)cn1 217236440 UYVPORNTGXALKC-UWVGGRQHSA-N 266.772 3.290 70 20 CGID O=S(=O)(Cl)c1ccc(C(F)(F)C2CC2)cc1 2332241300 QQNMVYHVKWABLN-UHFFFAOYSA-N 266.696 3.116 70 20 CGID C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239105 XRUOWEKRZZEVGE-MFKMUULPSA-N 299.367 3.110 70 20 CGID CC[C@H](C)[C@@H](C)NC[C@@H](O)COc1ccccc1Cl 218775285 OHMRFHGWGATGCT-YNEHKIRRSA-N 285.815 3.104 70 20 CGID C[C@@H]1CCN(C(=O)NC[C@H]2CC=CCC2)C[C@@H]1C 161121578 XNTCVMZNDHVZKZ-RDBSUJKOSA-N 250.386 3.030 70 20 CGID CCC[C@H]1CCc2c(sc(=O)n2Cc2nccs2)C1 161345742 FGCDTXJEHFNBST-JTQLQIEISA-N 294.445 3.320 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nn1cnc2ccccc21 160385329 JJXFSSXETQJUPU-RYUDHWBXSA-N 297.383 3.280 70 20 CGID Cc1cc(N[C@H]2CCO[C@@H](c3ccccc3)C2)nc(C)n1 160529075 NJTMZGSOXWXYTN-JKSUJKDBSA-N 283.375 3.426 70 20 CGID CCCC1(CNC(=O)c2ccccc2-c2nc(C)no2)CC1 160735079 WWVXQNNPADLQSQ-UHFFFAOYSA-N 299.374 3.355 70 20 CGID CCC(=O)c1cccc(NC(=O)c2cccc3cn[nH]c23)c1 160740621 PSDAEIFCTTZZAC-UHFFFAOYSA-N 293.326 3.408 70 20 CGID Cc1cc(N(C)C)ccc1NC(=O)N(C)[C@H]1CCSC1 160818656 BTAYEVZWXQLELI-ZDUSSCGKSA-N 293.436 3.030 70 20 CGID CC1=C(C(=O)NCCCn2ccc3ccccc32)CCCO1 159450096 MPAGWPPUNBPXIY-UHFFFAOYSA-N 298.386 3.232 70 20 CGID Cc1cc(NC(=O)c2ccn(C3CCCC3)n2)sn1 159868156 ISRWXGAFGPLHBC-UHFFFAOYSA-N 276.365 3.015 70 20 CGID CSCCCCC(=O)NCCO[C@H]1CCCC[C@@H]1C 159946914 AEZIXVKERVMQEE-KBPBESRZSA-N 287.469 3.231 70 20 CGID Cc1nc(NC(=O)C[C@@H]2CC[C@@H](C)C2)cc(C2CC2)n1 159956064 NCWVGCKTKNWXAR-ZYHUDNBSSA-N 273.380 3.427 70 20 CGID O=C(c1cccc2[nH]cnc12)N1CCc2ccc(Cl)cc21 159788437 APXVYDZJNUNOPD-UHFFFAOYSA-N 297.745 3.419 70 20 CGID CC(C)S(=O)(=O)CCCN1c2ccccc2CC[C@H]1C 160544356 MJESCIWOSOTRCO-CQSZACIVSA-N 295.448 3.041 70 20 CGID O=C(NOCc1cccnc1)[C@H]1CC[C@H]2CCCC[C@@H]2C1 161041129 NSBSHOTXLWABEO-OAGGEKHMSA-N 288.391 3.236 70 20 CGID CS[C@@H](C)CC(=O)NCCc1ccc(C)cc1C 161232689 ATHUVTWFHNZJEY-ZDUSSCGKSA-N 265.422 3.104 70 20 CGID COC(CN1Cc2ccccc2C[C@@H]1c1ccccc1)OC 161289729 GPSGXLVGFQYTAG-GOSISDBHSA-N 297.398 3.405 70 20 CGID CN(C[C@H]1CCOC1)C(=O)CC1CCC(C)(C)CC1 161402778 YFIYCKZNBXEARN-CQSZACIVSA-N 267.413 3.088 70 20 CGID CC1(C)CCC(C(=O)N2CCCC[C@H]2c2ncon2)CC1 161407469 DOWQDFZPQXUVHL-ZDUSSCGKSA-N 291.395 3.340 70 20 CGID Cc1c(C(=O)NCC2(C3CC3)CC2)cnn1-c1ccccc1 160059508 AJRBNIWRKYANCF-UHFFFAOYSA-N 295.386 3.101 70 20 CGID Brc1cncc(N[C@@H]2CCO[C@H](C3CC3)C2)c1 160348752 TUDQMDLIDNLNEV-YPMHNXCESA-N 297.196 3.214 70 20 CGID Brc1cncc(N[C@H]2CCO[C@@H](C3CC3)C2)c1 160349132 TUDQMDLIDNLNEV-WCQYABFASA-N 297.196 3.214 70 20 CGID Fc1ccc2oc(N[C@@H]3CCO[C@H](C4CC4)C3)nc2c1 160352054 GSOIJZOVECRSMN-RISCZKNCSA-N 276.311 3.336 70 20 CGID C[C@@H]1C[C@H]1CN[C@@H](CN)c1ccc2ccccc2c1 160685221 WVZXQEOMYCYJOE-DQYPLSBCSA-N 254.377 3.085 70 20 CGID CC1(C)CCC(CC(=O)N2CCOc3ncccc32)CC1 160930440 BZAZCNUXSRIERQ-UHFFFAOYSA-N 288.391 3.414 70 20 CGID CC[C@H](NCCOc1ccc(Cl)cc1)[C@H]1CCOC1 159640739 ICGRTQACGUZEDM-WFASDCNBSA-N 283.799 3.124 70 20 CGID C[C@H]1CCC[C@H](C)N(C(=O)c2cccc3[nH]cnc23)C1 159677168 FCQKZVNPMBOCCS-RYUDHWBXSA-N 271.364 3.214 70 20 CGID COc1ccc(N(C)C(=O)[C@@H](C)OCC2CC2)cc1Cl 159901721 CXYMVRPVGCFICX-SNVBAGLBSA-N 297.782 3.127 70 20 CGID CCS[C@H]1CCC[C@H]1NC(=O)CCCn1cccc1 159797828 GNQLVWAZVWGZJF-KGLIPLIRSA-N 280.437 3.059 70 20 CGID Cc1cccc([C@H]2CCCN2C[C@@H]2CCCCO2)n1 159827073 GWOKRMQJMBYQOW-GOEBONIOSA-N 260.381 3.096 70 20 CGID CCO[C@@H]1C[C@H](N[C@H](C)c2ccncc2)C12CCC2 160969455 PUKWAYDXSVUILL-VHDGCEQUSA-N 260.381 3.080 70 20 CGID CCC(CC)CNC(=O)N1CCCC[C@H]1c1ncc[nH]1 160553140 HWFSLESEVGCZDB-ZDUSSCGKSA-N 278.400 3.083 70 20 CGID C[C@H](CNC(C1CC1)C1CC1)N(C)Cc1ccccc1 160860165 MVCATLMQDYYJRE-CQSZACIVSA-N 272.436 3.285 70 20 CGID C[C@@H]1C[C@H]1c1ccc(CNC[C@@H](O)c2ccccc2)o1 217635006 WGWANKXRIJLYKD-DAXOMENPSA-N 271.360 3.226 70 20 CGID CC(C)NCCC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1 161046824 VPGNHNTWYRTURJ-XJKSGUPXSA-N 292.398 3.123 70 20 CGID O=C(NC[C@@H]1Cc2ccccc21)c1c(F)cc(F)cc1F 161046953 PZLQBURQPYPUSY-JTQLQIEISA-N 291.272 3.174 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)CCCc1cccs1 161423556 AGHJWMCIRMJKDS-RYUDHWBXSA-N 251.395 3.470 70 20 CGID C/C=C(\C=C\C(=O)NC[C@H](O)c1ccc(C)cc1)CC 160223977 OUZIZONMWIBIOV-DPOMQSEQSA-N 273.376 3.057 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N1CCN(c2cccc(C)c2)CC1 160254616 IKCDWOVCOCOLMH-FUHWJXTLSA-N 286.419 3.080 70 20 CGID CC[C@@H](CC(=O)N[C@H](CCO)C(C)C)c1ccccc1 160634375 DYABTMUALUFCAL-GOEBONIOSA-N 277.408 3.094 70 20 CGID CCc1cccc(NC(=O)NCC(C)(C)[C@H](O)C(C)C)c1 160916031 PEFWNBWGWXMQIN-OAHLLOKOSA-N 292.423 3.414 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(-c2nnco2)cc1 160940116 GYIFWYZXSKVAFB-SWLSCSKDSA-N 271.320 3.111 70 20 CGID COc1ccc(N[C@H](C)CCn2cccn2)c(C)c1 159406092 VCMNATSQBGPJQU-CYBMUJFWSA-N 259.353 3.091 70 20 CGID COc1ccc(CN(C)Cc2cnn(C(C)(C)C)c2)cc1 159873516 JGNYSNGCSVPVJR-UHFFFAOYSA-N 287.407 3.279 70 20 CGID CCCCO[C@@H](C)C(=O)N(C)c1ccc(OC)c(F)c1 159505227 UGCBLGGHDIFNRL-NSHDSACASA-N 283.343 3.002 70 20 CGID Cc1cc(N[C@H](C)c2ncc(C(C)(C)C)o2)nn1C 159576708 LVOWQZYNLDZNPW-SNVBAGLBSA-N 262.357 3.187 70 20 CGID O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCCCO1 159584333 PCINHXQFSSJOHD-KRWDZBQOSA-N 295.382 3.461 70 20 CGID CN(Cc1cnc(Cl)s1)OCc1ccccc1 159605775 UUAMKRGFQAGYRR-UHFFFAOYSA-N 268.769 3.360 70 20 CGID C[C@](CO)(NCc1cc(F)cc(Cl)c1)c1ccccc1 159794093 OFMMUYKWOAOHKY-MRXNPFEDSA-N 293.769 3.476 70 20 CGID Cc1cccc(C(=O)N2CCC[C@H]2c2ccc[nH]2)c1F 161459096 KYCXJFYZROGFPU-AWEZNQCLSA-N 272.323 3.440 70 20 CGID COc1ccc(O)c(C(=O)NC2(c3ccccc3)CCC2)c1 218424046 ZQXHCFWSJBPBLY-UHFFFAOYSA-N 297.354 3.210 70 20 CGID Cc1ccc(CCNC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 217307836 IOLWPNDQDLZWKP-GOEBONIOSA-N 274.408 3.415 70 20 CGID COC(=O)c1ccc(N[C@H]2CCC[C@H](SC)C2)nc1C 218023581 OSQJDRLCTHXSIF-RYUDHWBXSA-N 294.420 3.263 70 20 CGID CN(C[C@H](O)Cc1ccccc1)C1CCCCCC1 218770687 SXRKMLLXHLWLBV-QGZVFWFLSA-N 261.409 3.245 70 20 CGID CCNc1nc(C(=O)Nc2cccc3cccnc23)cs1 161342431 RHEHGZAALWUHBW-UHFFFAOYSA-N 298.371 3.375 70 20 CGID C[C@@H](NC(=O)N[C@H]1C=CCCC1)c1ccc(F)cc1F 161357730 RCEPHGXZIKVKFN-PWSUYJOCSA-N 280.318 3.434 70 20 CGID C[C@H](C(=O)N(CCN(C)C)C1CCCC1)c1cccs1 160059416 AIZHMBZFYQPTIH-ZDUSSCGKSA-N 294.464 3.184 70 20 CGID Cc1noc(C)c1CCSCc1noc(C(C)C)n1 160140712 YFJNSUGEVXKOFA-UHFFFAOYSA-N 281.381 3.274 70 20 CGID CC(C)(C)NC(=O)c1cccc(NCC2CCOCC2)c1 160197777 LGXMTAXHCLOXAA-UHFFFAOYSA-N 290.407 3.053 70 20 CGID CCSCc1cccc(NC(=O)c2ccc(CN)o2)c1 160423907 VWPIJSXJNJKIDO-UHFFFAOYSA-N 290.388 3.244 70 20 CGID CCC(N)(CC)CNC(=O)CCc1ccc(C(C)C)cc1 160551180 OBIRWSZVTBLNOK-UHFFFAOYSA-N 290.451 3.376 70 20 CGID CCN(C(=O)c1cccnc1O)[C@H](C)c1ccc(F)cc1 160627962 SPVCXPNRCGTYMS-LLVKDONJSA-N 288.322 3.150 70 20 CGID Cc1ccc(C)c([S@](=O)Cc2nccs2)c1 160632036 ZJBIBLDVAJYUHB-INIZCTEOSA-N 251.376 3.068 70 20 CGID COC[C@@H](NC(=O)NCc1ccc2ccccc2c1)C1CC1 159442695 GQQRDFOCTDABJN-QGZVFWFLSA-N 298.386 3.064 70 20 CGID Cc1cccn2cc(CNC(=O)[C@@H](C)c3ccsc3)nc12 159474818 TXXTWGBCOYPGQN-LBPRGKRZSA-N 299.399 3.124 70 20 CGID Cc1cccc([C@H](C)SCCN2CCOCC2)c1 159769430 QBZPEWXZXWTVPN-AWEZNQCLSA-N 265.422 3.121 70 20 CGID C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCCn1cccc1 159574700 RQQASCWVBDJLIY-OAGGEKHMSA-N 274.408 3.448 70 20 CGID COc1cc(CN[C@@H]2CCC[C@H](C)[C@@H]2C)cc2c1OCO2 218379640 RHGGXJFATZRDEY-SGMGOOAPSA-N 291.391 3.338 70 20 CGID CC(C)COc1ccc([C@H](C)S(=O)(=O)Cl)cc1 309801753 YEBHCZBKYNXCBK-JTQLQIEISA-N 276.785 3.351 70 20 CGID C[C@H](c1ccccc1Cl)N(C)C(=O)[C@H]1CCCCO1 161120036 OXWHONRATXTWFU-BXUZGUMPSA-N 281.783 3.429 70 20 CGID CCO[C@@H](C)c1nccn1Cc1cc(F)ccc1F 161452812 PTXAYBRBSUQDPI-JTQLQIEISA-N 266.291 3.307 70 20 CGID CCCCCNC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 160177135 HNJCJGSNHYBZJU-GXTWGEPZSA-N 296.436 3.410 70 20 CGID Cc1cc(C)c(C(=O)Nc2cc(F)cc(F)c2)[nH]1 160243455 YESVZYHMFKRLPV-UHFFFAOYSA-N 250.248 3.162 70 20 CGID CC[C@@H](NC(=O)c1n[nH]c2ccccc12)c1c(C)noc1C 160283805 JPCNGSUGEPTGFC-GFCCVEGCSA-N 298.346 3.049 70 20 CGID CC[C@@H](NC(=O)Cc1ccc(C)cc1)c1c(C)noc1C 160336318 IMCWWMNBXZMEDD-OAHLLOKOSA-N 286.375 3.410 70 20 CGID C[C@H]1CCCN(C(=O)N[C@H]2CCCC(C)(C)C2)C1 160721120 BQPORXMABPQGTR-STQMWFEESA-N 252.402 3.397 70 20 CGID O=C(NC1CC=CC1)c1occc1-c1ccccc1 160787113 BDPVJLOEJCZBIW-UHFFFAOYSA-N 253.301 3.395 70 20 CGID COc1ccc([C@H](NC(N)=O)c2ccccc2Cl)cc1 160824747 FIKMLZCZIHMZCC-AWEZNQCLSA-N 290.750 3.106 70 20 CGID CC[C@@H](NC[C@@H]1CCc2ccccc21)c1cnn(C)c1 160960576 KMHLZFFNXUXKSW-WMLDXEAASA-N 269.392 3.191 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(-c2nnco2)cc1 160939992 GYIFWYZXSKVAFB-DOMZBBRYSA-N 271.320 3.111 70 20 CGID CS(=O)(=O)CCCCSCc1ccc(F)cc1F 160964442 DIQOHVGGMWWCOB-UHFFFAOYSA-N 294.388 3.023 70 20 CGID CCCC(=O)N(C)[C@@H]1CCCc2nc(CC)sc21 160987515 MABWGVJPTKVDSF-LLVKDONJSA-N 266.410 3.341 70 20 CGID CC(C)(C)c1nc(CC(=O)NCC2(C3CC3)CC2)cs1 159806016 DNFSZMNMKVJOFX-UHFFFAOYSA-N 292.448 3.290 70 20 CGID CCn1c(SC(C)C)nc2ccc(F)cc2c1=O 159697172 FXPPIYIWTJTCPI-UHFFFAOYSA-N 266.341 3.056 70 20 CGID C[C@@H](c1cccs1)N(C)C(=O)[C@@H](O)c1ccccc1 159930344 YKCJRDRJWXFRGN-FZMZJTMJSA-N 275.373 3.001 70 20 CGID O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCCS1 159933046 OQQZWNCGTWTXEW-NXEZZACHSA-N 291.294 3.124 70 20 CGID Cc1nccc(NC(=O)N[C@@H]2CCCSC2)c1Cl 159364769 NEZQEOUUTLJLIM-SECBINFHSA-N 285.800 3.061 70 20 CGID Cc1cccnc1[C@H](NC(=O)CCCn1cccc1)C(C)C 159555511 RGDNGFMXEDIXDH-QGZVFWFLSA-N 299.418 3.485 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCCc3sccc32)cn1 159963945 JHAAXRKUSODRGO-ZDUSSCGKSA-N 272.373 3.259 70 20 CGID C[C@@H]1Cc2ccccc2[C@H]1NC[C@](C)(O)c1ccsc1 159964603 KVCBYWHSTXVBCQ-DQYPLSBCSA-N 287.428 3.479 70 20 CGID CCc1noc(C)c1CSCC(=O)N(C(C)C)C(C)C 159989771 JSOFRDMTWITNFC-UHFFFAOYSA-N 298.452 3.424 70 20 CGID COc1cc(NC(=O)c2cccc(F)c2F)ccc1F 160238287 RWWZNUJHJOTENJ-UHFFFAOYSA-N 281.233 3.365 70 20 CGID CCCn1c(CNC[C@](C)(O)CCC)nc2ccccc21 217805366 LIRNKJXDFIYWBP-QGZVFWFLSA-N 289.423 3.087 70 20 CGID CCCN(CCCC(=O)OC)CCc1cccc(F)c1 217223940 YLTRIMQXDCWSGW-UHFFFAOYSA-N 281.371 3.033 70 20 CGID CC[C@@H](C)NCc1c(F)cccc1Br 160260640 WLVXJRABLYCDNW-MRVPVSSYSA-N 260.150 3.476 70 20 CGID CC(=O)NC1CCC(Nc2ccc(C)c(C)c2)CC1 161079808 OZENISRRGFXSAU-UHFFFAOYSA-N 260.381 3.163 70 20 CGID Cc1ccccc1[C@@H](C)NC(=O)N[C@H](CCO)C(C)(C)C 161103041 WUBUDBVWNWKUPC-UKRRQHHQSA-N 292.423 3.152 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cccc(F)c1 160168439 SOBURPARLCLMBW-CQSZACIVSA-N 277.339 3.047 70 20 CGID CCOCCCCNC(=O)C(C)(C)C1CCCC1 160305612 KDDKVYHUQLLEJQ-UHFFFAOYSA-N 255.402 3.136 70 20 CGID CCc1ccc([C@@H](C)CC(=O)NCC(N)(CC)CC)cc1 160440467 MPSFAEDTGWHWCU-AWEZNQCLSA-N 290.451 3.376 70 20 CGID Cc1csc(CCNCc2cccc3c2NCCC3)n1 159414358 PGTIOVDSBJKNFC-UHFFFAOYSA-N 287.432 3.142 70 20 CGID CC[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OC 159517135 GDLOTIQARIQGBP-CABZTGNLSA-N 289.297 3.308 70 20 CGID Cc1cccc([C@@H](C)N[C@H](C)c2cn(C)nc2C)c1 160136538 NDNQDPDLFYKMNH-CHWSQXEVSA-N 257.381 3.449 70 20 CGID CCCCN(CC)C(=O)c1ccnc(Cl)c1F 160878654 OJYXTIALHZAYDT-UHFFFAOYSA-N 258.724 3.136 70 20 CGID CCOc1cc(F)ccc1NC(=O)N(C)[C@@H]1CCSC1 161288581 YCMCHYUKNURVKO-LLVKDONJSA-N 298.383 3.194 70 20 CGID CC(C)(C)C[C@H](CO)Nc1ccnc(-c2ccccc2)n1 161433530 WJABUFHSPAGCTI-CQSZACIVSA-N 285.391 3.353 70 20 CGID C[C@@H](N[C@H]1CCN(C2CCCCC2)C1=O)c1ccccc1 160157114 OSGKUNZRCXNAGJ-PBHICJAKSA-N 286.419 3.271 70 20 CGID Cc1nc2ccc(NC(=O)N[C@@H](C)C3CCC3)cc2o1 160364032 MXYLLTOQAPHMFN-VIFPVBQESA-N 273.336 3.446 70 20 CGID CCCC1(CNC(=O)Nc2cccc([S@@](C)=O)c2)CC1 160547550 XGYZKSADOSMWOQ-FQEVSTJZSA-N 294.420 3.126 70 20 CGID Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)[C@@H](N)C(C)(C)C)C1 159889450 KQJZQBORIWIDBY-IIAWOOMASA-N 288.435 3.073 70 20 CGID CCCCn1ncc(NC(=O)N2CC[C@@H](C)[C@H]2C)c1C 159937637 LTZBMMSSZFBBKX-VXGBXAGGSA-N 278.400 3.254 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(-c2cccnc2)on1 159591833 XMTDKIXEHHPZHW-YPMHNXCESA-N 285.347 3.045 70 20 CGID CCC(CC)[C@@H](O)CNC(=O)c1ccc(Cl)cc1C 160400978 WDIQGCQZCFMKTO-AWEZNQCLSA-N 283.799 3.175 70 20 CGID C[C@@H]1CCCC[C@H]1N(C)C(=O)CN(C1CCCC1)C1CC1 216859622 LVXQLQLYPLWLCS-RHSMWYFYSA-N 292.467 3.431 70 20 CGID CCCC(O)(CCC)CC(=O)Nc1cc([C@H]2C[C@H]2C)n[nH]1 161035155 JAKSUUZZFMJRAU-NEPJUHHUSA-N 293.411 3.193 70 20 CGID CCOCCC1(CNC(=O)c2cc(Cl)ccn2)CCC1 161273272 JQOLDFMPZNTXCX-UHFFFAOYSA-N 296.798 3.062 70 20 CGID Cc1ccc(NC(=O)N2C[C@H](C)CCC[C@H]2C)cn1 161329686 KWFSDTCANCXTGZ-DGCLKSJQSA-N 261.369 3.432 70 20 CGID CSCCCCC(=O)OCc1nc(C)sc1C 161486084 DUQIRFVBULWVOZ-UHFFFAOYSA-N 273.423 3.336 70 20 CGID Fc1ccc(F)c2c1CCN(CCCN1CCCCC1)C2 161491779 UHPMEWFZLFFWAB-UHFFFAOYSA-N 294.389 3.199 70 20 CGID CC(C)CCNC(=O)N1CCC[C@H](Nc2ccccc2)C1 160645061 CZKPODODGGADCO-INIZCTEOSA-N 289.423 3.319 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(-n2ccnc2)cc1 160816943 WMDSCLZERYISCR-GOEBONIOSA-N 269.348 3.247 70 20 CGID O=C(Nc1cccc(C(F)F)c1)N1CCOC2(CCC2)C1 160852890 ZFHLYDQPVKEKMU-UHFFFAOYSA-N 296.317 3.411 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)cc1F 160854598 JAZSWEJGVDJMHU-GFCCVEGCSA-N 280.343 3.213 70 20 CGID Cc1cc(NC(=O)c2cc(Cl)cc(Cl)c2)c[nH]c1=O 159689954 VUYVEKIDMJNVNO-UHFFFAOYSA-N 297.141 3.242 70 20 CGID CC(C)c1ccc(C(=O)NCCOc2ccccc2)cn1 159901749 PMIWUJFRLZGHFY-UHFFFAOYSA-N 284.359 3.014 70 20 CGID O=S(=O)(F)c1cc(Cl)ccc1C(F)(F)F 238852530 GKIPVTXDDYLMHL-UHFFFAOYSA-N 262.611 3.017 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(OC)cc1F 159616675 UMDYFKFKSLPBBS-QMTHXVAHSA-N 265.328 3.143 70 20 CGID CC[C@@H](C)[C@@H](NCc1ccc(Cl)cc1F)C(=O)OC 160743292 XRGFSGGSZJGCEB-NOZJJQNGSA-N 287.762 3.156 70 20 CGID CCc1ccc(NC(=O)NCCCC(=O)OC(C)C)cc1 161017513 PNJSDRWGJVXWTQ-UHFFFAOYSA-N 292.379 3.102 70 20 CGID Cc1cc(C(=O)N2CCc3c(F)cccc3C2)c(C)o1 161084456 DOQPTGSMYHYHJI-UHFFFAOYSA-N 273.307 3.234 70 20 CGID CC[C@@H](NCCCOc1c(C)cccc1C)[C@H]1CCOC1 161237463 XWXNVRIGADZVLK-DLBZAZTESA-N 291.435 3.477 70 20 CGID COC(=O)c1ccc(C(=O)NCC(C)(C)C2CCCC2)o1 160126998 XLBBMDFBIFCTBQ-UHFFFAOYSA-N 293.363 3.012 70 20 CGID CC(C)n1nccc1C(=O)N[C@@H]1CCC[C@H](C2CC2)C1 160231289 SIHVWXVYDGIZBG-UONOGXRCSA-N 275.396 3.163 70 20 CGID c1ccc2oc(N[C@@H]3CCO[C@H](C4CC4)C3)nc2c1 160318676 NEVJKAIEQJQXEZ-RISCZKNCSA-N 258.321 3.197 70 20 CGID Cn1cc(Nc2cccc(C(=O)N[C@@H]3C=CCCC3)c2)cn1 160381934 CYHLOPCLGCFSGB-CQSZACIVSA-N 296.374 3.002 70 20 CGID CS[C@@H](C)CC(=O)N(C)c1cc(C)ccc1C 160578484 BXSCQYQTCNNVPO-LBPRGKRZSA-N 251.395 3.408 70 20 CGID CC(C)C[C@H](C)NC(=O)NCc1nc(C2CC2)cs1 160634359 CKUMJPQMBCGAAF-JTQLQIEISA-N 281.425 3.254 70 20 CGID COc1ccc(N(C)C(=O)C[C@@H]2C=CCC2)cc1F 159553492 FVOMNKBIVGYEPI-LLVKDONJSA-N 263.312 3.153 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](C)[C@@H]2CCOC2)C1 159389630 PLOSILGSXVRRFR-REWJHTLYSA-N 257.443 3.065 70 20 CGID C[C@H](NC(=O)c1cc2ccccc2cc1O)C1CCC1 160223874 MSMUTZCJIRJOHE-NSHDSACASA-N 269.344 3.464 70 20 CGID Fc1cccc(C2CC(N[C@H]3CCN4CCCC[C@@H]34)C2)c1 217691870 DAIWEKBTOAOYMR-KXIUCKCTSA-N 288.410 3.288 70 20 CGID CC[C@@H](C)N(C)CCNCc1cccc2c1OC(C)(C)C2 217798227 FJBADPWZWCCXBK-CQSZACIVSA-N 290.451 3.220 70 20 CGID CC[C@H](C)NCc1c(F)cccc1Br 160260792 WLVXJRABLYCDNW-QMMMGPOBSA-N 260.150 3.476 70 20 CGID c1cc([C@@H]2CCCN2CCCN2CCCCC2)ccn1 161459809 HLONFDQAUHMAMV-KRWDZBQOSA-N 273.424 3.095 70 20 CGID C[C@@H]1CC[C@@H](CC(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237748 IVJQULABODPCMT-GHMZBOCLSA-N 299.367 3.110 70 20 CGID Clc1ccc(CCNCc2nccs2)s1 218153135 JUMVOYJUKXFKHE-UHFFFAOYSA-N 258.799 3.190 70 20 CGID Cc1nc2c(s1)[C@H](N[C@H]1CCC[C@H](N(C)C)C1)CCC2 161103126 JFIRFARKVNFTQW-KCQAQPDRSA-N 293.480 3.291 70 20 CGID O=C([C@@H]1CC[C@@H]2CCCC[C@H]2C1)N1CCOCC12CCC2 161189186 RMNHFLKGVDIKSN-HRCADAONSA-N 291.435 3.374 70 20 CGID Cc1cc([C@H](C)NC(=O)Cc2c(C)noc2Cl)c(C)o1 161420465 IWLCANJBPKEGJO-QMMMGPOBSA-N 296.754 3.266 70 20 CGID CCOCCC1(CNC(=O)N2C[C@@H](C)CCC[C@@H]2C)CC1 161509085 ZROSPHIUZXLLFH-GJZGRUSLSA-N 296.455 3.413 70 20 CGID CC(C)c1ccc(C(=O)N(C)c2ccccc2)cn1 160060200 JUVYJTJCSRDINC-UHFFFAOYSA-N 254.333 3.482 70 20 CGID Cc1cc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)oc1C 160242380 OQIBNFZHTPCEEA-LLVKDONJSA-N 298.342 3.131 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCC1(c2ccccc2)CC1 160414828 SQRXNLNSDQYJON-GOEBONIOSA-N 257.377 3.271 70 20 CGID COC[C@H](NCCCc1nc2c(s1)CCCC2)C(C)C 160623277 CLSRVWWGEKOYCZ-AWEZNQCLSA-N 296.480 3.215 70 20 CGID c1ccc([C@@H]2C[C@H](Nc3ccccn3)CCO2)cc1 160629469 RWAGVDPTYJPTOJ-CABCVRRESA-N 254.333 3.414 70 20 CGID C[C@@H](NC[C@@H](C)N1CCc2ccccc2C1)c1ccco1 159820325 HOOMTGWQLFIGGG-HUUCEWRRSA-N 284.403 3.377 70 20 CGID CC[C@H](NC(=O)Nc1ccc(C)cc1F)[C@@H]1CCCO1 159439411 JRKHHEJDHKZUOF-JSGCOSHPSA-N 280.343 3.213 70 20 CGID O=C(CCC1CC1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159442730 BZSJLKTUSWMTME-DOTOQJQBSA-N 287.403 3.461 70 20 CGID C(=C/c1ccccc1)\CN[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 159480983 MLQNMOQZDIYCDP-QRUNAMSGSA-N 269.388 3.247 70 20 CGID Cc1ccc(C(=O)CCN2CCC3(CCC3)C2)cc1 160149613 GBTUYSCNNKSHHQ-UHFFFAOYSA-N 257.377 3.444 70 20 CGID COc1cc(N[C@@H]2CCOC3(CCC3)C2)ccc1F 160298656 OPWZHGQVDIVZTI-GFCCVEGCSA-N 265.328 3.348 70 20 CGID C1CCN(CCCN2CCC[C@H]3CCC[C@@H]32)CC1 161377793 LPUOVRWECJGQHX-CVEARBPZSA-N 250.430 3.127 70 20 CGID Cc1nc(-c2ccccc2NC(=O)c2cnccn2)cs1 218593436 UCOWYMJFWRNOHP-UHFFFAOYSA-N 296.355 3.161 70 20 CGID CCO/C=C/C(=O)Nc1ccc(C(F)(F)F)cc1 217689740 TZXPPPLAZKKWDZ-BQYQJAHWSA-N 259.227 3.194 70 20 CGID Brc1cncc(CN[C@H]2CC=CCC2)c1 160584523 NOXPURIOIVHLDX-LBPRGKRZSA-N 267.170 3.042 70 20 CGID CC(C)n1ccnc1CN1CC[C@H](c2ccccc2)C1 160875669 VJJKBFZGSBCJSY-INIZCTEOSA-N 269.392 3.454 70 20 CGID C[C@H]1Cc2ccccc2N(C[C@@H](O)c2ccccc2)C1 217543793 VJIOWUNUWKSVIO-KBXCAEBGSA-N 267.372 3.419 70 20 CGID C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H]1CCCCO1 161094352 GRZZARMWRNBWGF-RISCZKNCSA-N 281.783 3.429 70 20 CGID CCN(CC)CCC[C@@H](C)NC(=O)[C@@H]1CCC[C@H](C)C1 161291310 NUIXYWMRUPWTHI-ARFHVFGLSA-N 282.472 3.439 70 20 CGID COc1ccc(NC(=O)C[C@@H]2CCc3ccccc32)cc1N 161345156 CISLDECQIDXNGH-ZDUSSCGKSA-N 296.370 3.336 70 20 CGID C[C@H](CC(=O)N(C)[C@H](C)C1(C)CC1)c1ccncc1 161419233 SJUJUSIALIVUSG-CHWSQXEVSA-N 260.381 3.222 70 20 CGID CCc1ccc(Cl)c(CC)c1NC(=O)NC1(CO)CC1 160084351 ONARQPUDNFNCOZ-UHFFFAOYSA-N 296.798 3.111 70 20 CGID CCSCc1cccc(NC(=O)[C@@H]2CCC[C@H](N)C2)c1 160422800 DQFOQZKEYCYUIT-KGLIPLIRSA-N 292.448 3.396 70 20 CGID CSC[C@@H](CCO)N[C@@H](Cc1ccc(C)cc1)C1CC1 160437231 OZZNLYZFYZSTSM-SJORKVTESA-N 293.476 3.020 70 20 CGID CC[C@@H](C)[C@@H](C)NC(=O)Nc1ccn(CC(F)(F)F)n1 160570833 PNIYUDYGXLNXRW-RKDXNWHRSA-N 292.305 3.002 70 20 CGID COc1cc(CN[C@@H]2CCOC(C)(C)C2)ccc1SC 160627577 PDIZQXUWPPBOIL-CYBMUJFWSA-N 295.448 3.464 70 20 CGID C[C@H](CC(=O)N[C@H]1CCCSC1)c1ccc(F)cc1F 160829196 ABTXYFURVHBOSE-PWSUYJOCSA-N 299.386 3.470 70 20 CGID Cc1cccc(C)c1NC(=O)N[C@@H]1CCOC(C)(C)C1 160950981 YAEBBTUKOCMDHQ-CYBMUJFWSA-N 276.380 3.383 70 20 CGID CCc1ccc(NC(=O)N[C@@H](CC)[C@@H]2CCCO2)cc1 159409734 VHIJLEWGQVLHOS-GJZGRUSLSA-N 276.380 3.328 70 20 CGID Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](C)[C@H]1CCOC1 159836931 GMDYPGQBVSVFAT-BBRMVZONSA-N 299.418 3.004 70 20 CGID CC(C)CCn1ccc(NC(=O)N2C[C@H]3CCC[C@@H]3C2)n1 159674798 NWBZMNLOUIPOLV-ZIAGYGMSSA-N 290.411 3.193 70 20 CGID CC(C)(CNC(=O)CNc1ccccc1)Cc1ccccc1 159487270 ADLXPJNNDIBVDX-UHFFFAOYSA-N 296.414 3.484 70 20 CGID CC1(C)C(C(=O)N[C@H]2CCOC3(CCCC3)C2)C1(C)C 159900633 PQIUHPQHUUPNTM-LBPRGKRZSA-N 279.424 3.277 70 20 CGID Cc1cccc2nc(CN3CC[C@@H]4CCCC[C@@H]43)cn12 159732418 QELMOJQBDMZRGN-HOCLYGCPSA-N 269.392 3.407 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cnc(-c2ccccc2)nc1 159555167 QUDQSTIYNMWTBP-CJNGLKHVSA-N 295.386 3.452 70 20 CGID Cc1ccc(C(=O)N[C@H](C)C[C@@H](O)c2ccccc2)cc1 218679382 LEEPNCXGASNCIA-RHSMWYFYSA-N 283.371 3.237 70 20 CGID CC[C@H](CC(=O)Nc1ccc(OC)c(N)c1)C(C)C 161016266 RODNVPLQZZBMOZ-LLVKDONJSA-N 264.369 3.288 70 20 CGID CO[C@H](C(=O)N1CCC[C@H]1c1ccncc1)c1ccccc1 161302568 QTXLBAAZMIAHTC-IRXDYDNUSA-N 296.370 3.133 70 20 CGID Cn1nccc1CSc1ccccc1Br 161302867 UUJIPIPTZOMBFK-UHFFFAOYSA-N 283.194 3.475 70 20 CGID Cc1nc(C(C)C)sc1[C@H](C)NC1CCN(C)CC1 161441634 WFIMRLDEBCNMQR-NSHDSACASA-N 281.469 3.320 70 20 CGID CO[C@H](C)CCC(=O)N[C@H]1CCCc2sccc21 160163404 NSGFRDWFYPTBKA-PWSUYJOCSA-N 267.394 3.057 70 20 CGID CCSc1ccc([C@H](C)NCc2n[nH]c(CC)n2)cc1 160410390 MZKRKZXTKPWAEC-NSHDSACASA-N 290.436 3.330 70 20 CGID CN(Cc1cccn1C)C(=O)C[C@H]1CCc2ccccc21 160571689 XODYSZSHJPYTJS-OAHLLOKOSA-N 282.387 3.104 70 20 CGID CC[C@@H](NC(=O)CCC(C)C)c1c(C)noc1C 160682092 RRVOWBFHBOZVQB-GFCCVEGCSA-N 252.358 3.295 70 20 CGID C[C@H](C[C@H]1CCCO1)NC(=O)C1CCC(C)(C)CC1 159803483 LVBNUZQVNIIYPU-TZMCWYRMSA-N 267.413 3.277 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc2c(c1)CCC2 159840457 TZQPUDFYFPFQJK-KRWDZBQOSA-N 299.414 3.397 70 20 CGID Cc1cccc2c1CC[C@@H]2N[C@@H]1CCC[C@H](N(C)C)C1 161020258 KQQJAFLEJJJWLR-VKJFTORMSA-N 272.436 3.445 70 20 CGID CS[C@H](C)CC(=O)N(C)c1ccc(F)c(F)c1 160920902 VTHUNMSSJKCYJO-MRVPVSSYSA-N 259.321 3.069 70 20 CGID CCCN(C(=O)C1CCC1)[C@@H](C)C(=O)Nc1ccccc1 161440401 WRZQPHRKCMYVFN-ZDUSSCGKSA-N 288.391 3.052 70 20 CGID Cc1ccc(-c2nnc(NC(=O)CCC3CCCC3)[nH]2)o1 160400812 FWMLQKNECLGSMJ-UHFFFAOYSA-N 288.351 3.282 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)c1nnnn1-c1ccccc1 160575671 JWZJAHJVXUFHQX-KBPBESRZSA-N 287.411 3.091 70 20 CGID Cc1cccc(F)c1NS(=O)(=O)Cc1ccccc1F 160840873 LDJZWWHJUICWJE-UHFFFAOYSA-N 297.326 3.215 70 20 CGID CCc1ccc(CC(=O)NCC2(C3CC3)CC2)cc1 159860909 RZYQJNNDQRYWDF-UHFFFAOYSA-N 257.377 3.098 70 20 CGID C[C@@H]1CCC[C@@H](C)N(C(=O)c2cccc3[nH]cnc23)C1 159677316 FCQKZVNPMBOCCS-VXGBXAGGSA-N 271.364 3.214 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)OCCC(C)C 159723163 NLWFIZVGWZMARQ-MCIONIFRSA-N 255.402 3.133 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1ccccc1OC 160086387 ZJWNAUMLVQAIBJ-KGLIPLIRSA-N 264.413 3.076 70 20 CGID c1cc2c(cc1[C@H](N[C@H]1CCSC1)C1CC1)OCCO2 161123242 JCVOGCJFXKLUSS-XJKSGUPXSA-N 291.416 3.004 70 20 CGID CSc1ccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)cc1 161402738 WGCLOQQPYMCURG-GFCCVEGCSA-N 294.420 3.488 70 20 CGID CCSc1cc(C(=O)N2[C@H](C)CC[C@H]2C)ccn1 161483994 XUUFPENUTCAAAF-GHMZBOCLSA-N 264.394 3.207 70 20 CGID Cc1[nH]ccc1C(=O)N[C@@H]1CCCc2sccc21 160006505 JBUDHIRPGFGPPE-GFCCVEGCSA-N 260.362 3.192 70 20 CGID Cc1cc(NC(=O)CCCc2sccc2C)[nH]n1 160082671 WQZYPGGJEKWQCL-UHFFFAOYSA-N 263.366 3.049 70 20 CGID CC[C@H](NC(=O)C(C1CC1)C1CC1)c1c(C)noc1C 160216397 YZLBTVQXERVIJG-ZDUSSCGKSA-N 276.380 3.295 70 20 CGID CCSCc1cccc(NC(=O)CC2CCNCC2)c1 160424061 HXVDOKZERHKZOM-UHFFFAOYSA-N 292.448 3.268 70 20 CGID C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@@H]1CCCCO1 160593043 LZTRHUSLKIQCRB-HZMBPMFUSA-N 283.318 3.053 70 20 CGID Cc1c(/C=C/C(=O)N(C2CC2)[C@H](C)c2ccco2)cnn1C 160886701 IXLGLDJPRRKOQY-YSKGHYERSA-N 299.374 3.087 70 20 CGID COc1ccc(N(C)C(=O)Cc2ccccc2C)cc1F 159464349 MNJZKMWKFXGSDD-UHFFFAOYSA-N 287.334 3.348 70 20 CGID CC[C@@H]1CCCCN1C(=O)[C@H](C)Sc1ccncc1 159870158 XVZCOOPIQBQANI-QWHCGFSZSA-N 278.421 3.353 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)NCc2cccc(CN(C)C)c2)C1 159717098 FICARLJCDKSFRB-RHSMWYFYSA-N 288.435 3.191 70 20 CGID CCCn1nccc1CNCCCc1ccccc1 159976320 KVZPCPXPLWWPTA-UHFFFAOYSA-N 257.381 3.016 70 20 CGID CCO[C@@H]1C[C@H](Nc2ccc(F)c(OC)c2)C1(C)C 160103533 QOBKMTLBXUZRNH-UONOGXRCSA-N 267.344 3.450 70 20 CGID C[C@@H](NC(=O)c1cc2ccccc2cc1O)C1CCC1 160223985 MSMUTZCJIRJOHE-LLVKDONJSA-N 269.344 3.464 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NCc1ccc(C(N)=O)cc1)C2 218574472 HGEZVUVXCRIKMV-MPGHIAIKSA-N 286.419 3.090 70 20 CGID CCc1ncnc(NCCc2ccc(F)cc2C)c1F 218064739 FIOKQBWRRFBEGU-UHFFFAOYSA-N 277.318 3.280 70 20 CGID CC(C)(C(=O)N[C@H]1CCC[C@@H](N)C1)c1ccccc1Cl 161285189 PGKFSHMIVCRKJR-NEPJUHHUSA-N 294.826 3.004 70 20 CGID Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)CCNC(C)C)C1 161289996 PXTLFUZGHCQTJU-JKSUJKDBSA-N 288.435 3.088 70 20 CGID CC1=NN(c2ccc(C(=O)N3[C@@H](C)CC[C@@H]3C)cc2)CC1 161477554 RCCQLUBXTIYHOI-KBPBESRZSA-N 285.391 3.286 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc2c(c1)NC(=O)CS2 160184221 OMEOLZUGFIQAIK-BONVTDFDSA-N 290.388 3.106 70 20 CGID O=C(CCC1CC1)O[C@@H](c1ccccn1)C(F)(F)F 160268902 UMNIVXYSZLLPNR-LBPRGKRZSA-N 273.254 3.418 70 20 CGID CCOc1ccc(CN[C@@H]2CCOC(C)(C)C2)cc1OC 160470456 XPTIUVVVOZXVEU-CQSZACIVSA-N 293.407 3.141 70 20 CGID Cc1nc2n(n1)C[C@@H](N[C@H]1CC[C@H](C)c3ccccc31)CC2 160493985 RYFXMQOYVGYOPF-JDFRZJQESA-N 296.418 3.130 70 20 CGID Cc1occc1C(=O)N[C@@H](C)CC(=O)c1cccs1 160870283 QYNFXDIVHJFUGI-VIFPVBQESA-N 277.345 3.041 70 20 CGID CCc1ccc([C@@H](CO)Nc2cnc3ccccc3n2)cc1 160916864 JSKWTLLTAYNOQW-QGZVFWFLSA-N 293.370 3.338 70 20 CGID CCCCCNC(=O)[C@@H](C)Nc1ccn(CCC(C)C)n1 159868965 NONOTWCYDHHHOF-CQSZACIVSA-N 294.443 3.036 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CC[C@H](C)[C@@H]2C)n1 159695174 BAOCZWYWDWXKCT-STQMWFEESA-N 278.400 3.191 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)Cc1ccco1 159514742 DOVXWZPJSXJDTP-STQMWFEESA-N 275.373 3.412 70 20 CGID CCC[C@H](C)CS(=O)(=O)N(C)[C@@H](CC)c1ccncc1 159742643 NJYUAMDCQXETCB-ZFWWWQNUSA-N 298.452 3.231 70 20 CGID CC[C@H](NC(=O)c1cccc(OC)c1)c1c(C)noc1C 159943306 SAVJJMYCKDTAFL-AWEZNQCLSA-N 288.347 3.181 70 20 CGID Cc1noc(C)c1[C@@H](C)CNC(=O)NCC1(C(C)C)CC1 159557424 JWQWXGPBZADPPI-NSHDSACASA-N 293.411 3.130 70 20 CGID CS[C@H]1CCC[C@H](NC(=O)CCCn2cccc2)C1 159588160 JEWNLXPMSJSRKS-KBPBESRZSA-N 280.437 3.059 70 20 CGID CN(C(=O)c1ccc2c(c1)CNCC2)C1CCCCCC1 217091998 UBMZJAIMXOQNJD-UHFFFAOYSA-N 286.419 3.127 70 20 CGID C[C@H]1CCC[C@H](CNC(=O)c2[nH]nc3ccccc23)C1 218009324 VWRMEIBSRRUEPD-RYUDHWBXSA-N 271.364 3.119 70 20 CGID Cc1ccnc(N2CC=C(c3ccc(O)cc3)CC2)c1 161214672 XCIJTOOXIZYTKA-UHFFFAOYSA-N 266.344 3.389 70 20 CGID C[C@@H]1CN(C)CC[C@@H]1NCCSc1ccc(Cl)cc1 160063554 QRHOMXOSLJVRHY-DOMZBBRYSA-N 298.883 3.362 70 20 CGID CN(C)Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)cc1 160064720 ZDDONPQMNOJSEI-QGZVFWFLSA-N 297.402 3.054 70 20 CGID CCc1ccc([C@@H](C)NCCN(C)[C@@H](C)CC)o1 160151854 BFPGGAYQOHXYJC-QWHCGFSZSA-N 252.402 3.223 70 20 CGID O=C(Cc1ccsc1)N[C@@H]1CCOC2(CCCCC2)C1 160280266 HRNCYSUDZBBIQU-CQSZACIVSA-N 293.432 3.289 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(-c2nnco2)cc1 160940264 GYIFWYZXSKVAFB-WFASDCNBSA-N 271.320 3.111 70 20 CGID CCSc1ccc(C(=O)NCC2(C3CC3)CC2)cn1 159882742 NYSPMCGXHFVGMJ-UHFFFAOYSA-N 276.405 3.114 70 20 CGID C[C@H](N[C@H]1CCOC(C)(C)C1)c1ccc(-n2ccnc2)cc1 159933995 JKPFUKNUCVAVFO-HOCLYGCPSA-N 299.418 3.481 70 20 CGID COC(=O)c1ccccc1CN1CCC[C@@H](C)[C@@H]1C 217611067 NYYGHBMGIISFCN-OLZOCXBDSA-N 261.365 3.094 70 20 CGID Cc1c([C@@H](C)NCc2cccc3cc[nH]c23)cnn1C 218105129 LCOJIKICDCLQSI-LLVKDONJSA-N 268.364 3.061 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cccc(C)n1 161284809 CQPXIRVDYCVSRR-DZGCQCFKSA-N 260.381 3.431 70 20 CGID CCOC[C@H](O)CN[C@H](CC(C)C)c1ccccc1C 161378392 AAJPCVMATXGNCY-NVXWUHKLSA-N 279.424 3.069 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1c(F)cccc1F 160170212 VSEJPPCNRMSLJS-NSHDSACASA-N 295.329 3.186 70 20 CGID Cc1ccsc1C(=O)N(C)c1ccc2c(c1)OCO2 160376134 ARWBUTQDKTXVBS-UHFFFAOYSA-N 275.329 3.062 70 20 CGID CCN(CC)C[C@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160811206 YDFSEGBCYOMVJE-OAHLLOKOSA-N 294.483 3.393 70 20 CGID CC[C@H](C)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159475029 BMZXNAKLTIYDCP-DZKIICNBSA-N 275.392 3.317 70 20 CGID CCN(CCNC(=O)C[C@H](C)SC)c1ccccc1C 159362082 XLYARPUPVFFAAW-AWEZNQCLSA-N 294.464 3.079 70 20 CGID Cc1cccc([C@H](C)NC2C[C@@H]3CC[C@H](C2)N3C)c1 160177069 TVXZAXGVTCQAOF-LNRIEFBSSA-N 258.409 3.271 70 20 CGID Fc1cc(Cl)ccc1CN[C@@H]1CCN2CCCC[C@H]12 160715116 WSHYMKYYPAIJKK-HUUCEWRRSA-N 282.790 3.196 70 20 CGID CCc1ncnc(NC[C@@]2(N(C)C)CCC[C@H](C)C2)c1F 217985848 BZGIEPJTRBWKCC-BLLLJJGKSA-N 294.418 3.101 70 20 CGID CCN(C(=O)c1ccc(C)cc1Br)C1CC1 161076508 WMVVQTOXVLPIJX-UHFFFAOYSA-N 282.181 3.382 70 20 CGID CC(=O)NC1CCC(Nc2ccc(OC(F)F)cc2)CC1 161082034 CLHIWNRHOANYNS-UHFFFAOYSA-N 298.333 3.147 70 20 CGID CCN1CCCC[C@H]1CN[C@@H](C)c1ccc(OC)cc1 161203162 XQXJVAURNSJSGT-HOCLYGCPSA-N 276.424 3.220 70 20 CGID COc1ccc(NC(=O)C[C@@H](C)CC(C)C)cc1N 161284207 XJHVQRFVJBSHMO-NSHDSACASA-N 264.369 3.288 70 20 CGID CN(CCCN1CCCCC1)Cc1cccc(N(C)C)c1 161444663 TUGFQKLISUDDCB-UHFFFAOYSA-N 289.467 3.060 70 20 CGID COc1ccc2c(c1)CCC[C@@H]2NCC1(CO)CCCC1 160070914 UBBHVDRDJQMWRL-KRWDZBQOSA-N 289.419 3.215 70 20 CGID CN(C[C@H]1CCCOC1)C(=O)C1CCC(C)(C)CC1 160136514 VXIVRPBOOHFSIO-CYBMUJFWSA-N 267.413 3.088 70 20 CGID CC(C)CCOc1ccc(NC(=O)[C@@H](N)C(C)(C)C)cc1 160304814 ZVKPQFPFFQLUTK-OAHLLOKOSA-N 292.423 3.423 70 20 CGID CCS[C@H]1CCCCN(Cc2cnc3ccccn23)C1 160363981 LRKBWBRAFWGWAK-HNNXBMFYSA-N 289.448 3.442 70 20 CGID CC(C)C[C@H](C)NC(=O)N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 160578610 CYKIYMNTCXHVMA-VCOSZWKGSA-N 272.392 3.059 70 20 CGID Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cn[nH]c2)c1 160625872 JEIMWPRSMPAAML-OAHLLOKOSA-N 269.348 3.004 70 20 CGID COC(=O)c1cc(CN(C)Cc2ccccc2Cl)c[nH]1 160821641 AMSXQWQCONNCTK-UHFFFAOYSA-N 292.766 3.087 70 20 CGID CC(C)(C(=O)NC1CC=CC1)c1cccc(Cl)c1 160838822 XQVAHDRTDYMREA-UHFFFAOYSA-N 263.768 3.452 70 20 CGID FC(F)(F)Oc1cccc(Cc2nc(C3CC3)no2)c1 160909503 HIKBGEHARQQXII-UHFFFAOYSA-N 284.237 3.436 70 20 CGID CCOC(=O)c1sc(NC(=O)[C@H]2C[C@]2(C)CC)nc1C 159437391 BSWSOSOYWCIHJB-OTYXRUKQSA-N 296.392 3.003 70 20 CGID Cc1cc(NC(=O)c2ccccc2C(C)(C)C)c[nH]c1=O 159843008 ZIJZDIOQADMUCD-UHFFFAOYSA-N 284.359 3.233 70 20 CGID CCO[C@@H]1CCCN(C(=O)NCC(CC)(CC)CC)C1 159651287 PXDHZUCORFKAOZ-CQSZACIVSA-N 284.444 3.413 70 20 CGID Cc1cc(C(=O)NCCOc2ccccc2Cl)oc1C 159492472 IUNIQJVIADTBHE-UHFFFAOYSA-N 293.750 3.359 70 20 CGID CCc1noc(C)c1CNc1ccc(-n2cccn2)cc1 159393896 ZZTHZMBUKMCDIL-UHFFFAOYSA-N 282.347 3.343 70 20 CGID O=C(NCc1ccco1)Nc1c(F)cccc1Cl 217313134 GJUZXDOWDANCJO-UHFFFAOYSA-N 268.675 3.394 70 20 CGID O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCCC1 217806621 HOVHKJPHKDFKPE-QWHCGFSZSA-N 294.192 3.175 70 20 CGID CN(C)c1ccnc(N[C@H]2CCCc3sccc32)n1 161069448 GWMNIWQSOASYRB-NSHDSACASA-N 274.393 3.094 70 20 CGID CC[C@H](SC)c1nc(Cc2ccc(OC)cc2)no1 161276318 WVLGUYBLTFNSJJ-LBPRGKRZSA-N 278.377 3.483 70 20 CGID COc1ccc(N(C)C(=O)[C@H]2C[C@H]2C2CC2)cc1Cl 160311787 BYPWOMIZQJBPMD-RYUDHWBXSA-N 279.767 3.358 70 20 CGID CCn1c(C)nnc1SCC(=O)CCC1CCCC1 160381009 GQKFGEKMTKMOLF-UHFFFAOYSA-N 281.425 3.238 70 20 CGID Clc1cc(N[C@@H]2CCO[C@H](C3CC3)C2)nc(C2CC2)n1 160474024 LAXUWAXXWYUWAX-NEPJUHHUSA-N 293.798 3.377 70 20 CGID CC[C@@H](NC[C@H]1CCCO1)c1ccc(F)cc1F 160652432 XRUSSEDDCHQNIE-BXUZGUMPSA-N 255.308 3.185 70 20 CGID Cc1cncc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)c1 160878905 ZMVYZDFJYSJUQC-HNNXBMFYSA-N 288.391 3.002 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)/C=C(/C)C2CC2)n1 160971292 OZFGECXSFVELLA-KHPPLWFESA-N 296.374 3.329 70 20 CGID CC(C)CC1(CNC(=O)NC2C[C@H](C)O[C@@H](C)C2)CCC1 159917264 GCBZSQYHLLQQKU-KBPBESRZSA-N 296.455 3.458 70 20 CGID CCN(C(=O)Cc1ccc(O)cc1Cl)C1CCCC1 159569013 LNBWIAVYBAXTGT-UHFFFAOYSA-N 281.783 3.379 70 20 CGID CC1(C)C[C@@H](NCc2cnc(C3CC3)s2)CCO1 160468971 BVBXAOFYSBPBOW-NSHDSACASA-N 266.410 3.068 70 20 CGID Cc1ccc(SCCC(=O)NC(C)(C)CCO)cc1C 161494451 LGRHYSUMKAXLRK-UHFFFAOYSA-N 295.448 3.063 70 20 CGID COc1ccc(CN(C)Cc2ccsc2)cc1OC 160827593 DMHCYWMZZHHKQL-UHFFFAOYSA-N 277.389 3.397 70 20 CGID O=C([C@@H]1CCCCO1)N(Cc1ccc(Cl)cc1)C1CC1 161014194 XFOUZZCBQKLTOL-HNNXBMFYSA-N 293.794 3.400 70 20 CGID CCSCC[C@H](C)NC(=O)Nc1ccc(C)nc1 161444529 PEAWUSRSYGONFI-NSHDSACASA-N 267.398 3.043 70 20 CGID O=C(NCCc1ccc(-c2ccccc2)cc1)[C@H]1CCOC1 160039298 DZQFZDXKWAFWJG-SFHVURJKSA-N 295.382 3.049 70 20 CGID CC(C)C[C@@H](C)NC(=O)Nc1ccccc1-n1cccn1 160164097 GLSSBTRRDTWMNB-CYBMUJFWSA-N 286.379 3.428 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 160518600 JZMWDUPDEIWPHT-YOEHRIQHSA-N 286.375 3.410 70 20 CGID CN(Cc1cccn1C)C(=O)c1c(F)cccc1Cl 160836013 PEUXYOQQQAMPBY-UHFFFAOYSA-N 280.730 3.090 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(C)nc2onc(C)c12 159606857 HVCQRGKDBRISCM-WCQYABFASA-N 287.363 3.148 70 20 CGID CC(C)(C)c1nsc(NC[C@]2(C)CCCC[C@H]2O)n1 159829026 XNATVMXFSZSYGI-YGRLFVJLSA-N 283.441 3.189 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)[C@H]2CCCOC2)C1 159523771 ZEFVKPLSXJYRNV-OLZOCXBDSA-N 291.416 3.188 70 20 CGID CCOCCCNC1(c2ccc(Br)cc2)CC1 159932837 VRRXECZAYPQMRS-UHFFFAOYSA-N 298.224 3.454 70 20 CGID CC[C@@H](C)OCC(=O)Nc1ccc(N(C)C)c(Cl)c1 159735956 ZXHFFBGXPDIFSF-SNVBAGLBSA-N 284.787 3.160 70 20 CGID CC(C)[C@H](CCO)NC(=O)c1csc2c1CC[C@H](C)C2 161288636 RUSVINJIXFXANG-FZMZJTMJSA-N 295.448 3.010 70 20 CGID CN(CCn1ccnc1)Cc1ccccc1C(F)(F)F 159711254 IPTCAYYNDOQBIY-UHFFFAOYSA-N 283.297 3.034 70 20 CGID C=CCC(CC=C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 123146037 IJAHBSPXZMFXQM-UHFFFAOYSA-N 297.351 3.052 70 20 CGID CC(C)c1ccccc1NCc1nnc2n1CCCC2 217317494 CMQQDKSKRAQTDA-UHFFFAOYSA-N 270.380 3.350 70 20 CGID CSC[C@](C)(O)CNCc1ccc2ccccc2c1 217847555 JSVQKDWKZOYLFG-MRXNPFEDSA-N 275.417 3.043 70 20 CGID CCC(CC)c1cc(C(=O)NCCOC2CCCC2)on1 161171299 FONBMYSYXWAQTN-UHFFFAOYSA-N 294.395 3.267 70 20 CGID c1cc(-c2noc(CSCc3cscn3)n2)ccn1 161339144 ODMOHZAUPAJWNM-UHFFFAOYSA-N 290.373 3.022 70 20 CGID C[C@@H](Cc1ccccc1Cl)C(=O)N1CCO[C@H](C)[C@H]1C 160042132 JEFPSOPHFUNKII-YNEHKIRRSA-N 295.810 3.154 70 20 CGID O=C(COc1ccc(F)c(Cl)c1)NCC1(C2CC2)CC1 160046229 BPJGMBGILMKGJP-UHFFFAOYSA-N 297.757 3.164 70 20 CGID CCC1(C(=O)N[C@@H]2CCc3c(OC)cccc32)CCC1 160157819 AEIHKAQWQVMBNC-CQSZACIVSA-N 273.376 3.379 70 20 CGID Fc1ccc2oc(N[C@H]3CCO[C@H](C4CC4)C3)nc2c1 160352172 GSOIJZOVECRSMN-FZMZJTMJSA-N 276.311 3.336 70 20 CGID O=C(N[C@H]1C=CCCC1)c1cc(F)cc(Cl)c1O 160381510 JHSLYXYZDKVWIY-VIFPVBQESA-N 269.703 3.023 70 20 CGID CN(Cc1cccn1C)C(=O)c1coc2ccccc12 160725080 PWCWDXCDMUZTJN-UHFFFAOYSA-N 268.316 3.044 70 20 CGID CC(C)CSCCCNC(=O)CCCn1cccc1 160744897 VHLPDJQTHKADJI-UHFFFAOYSA-N 282.453 3.164 70 20 CGID CC(C)CC(CC(C)C)NC(=O)N(C)C[C@H]1CCC[C@H]1O 160762076 WIQGTOGWDRHVAQ-GDBMZVCRSA-N 298.471 3.250 70 20 CGID CC(C)[C@@H]1CN(C(=O)C[C@@H](C)c2ccncc2)CCS1 160826649 PQRAACXXKVJKEW-HIFRSBDPSA-N 292.448 3.175 70 20 CGID CC(C)CCC(=O)N[C@@H]1CCOC2(CCCCC2)C1 160974730 JHVPLUDRZAWLLT-CQSZACIVSA-N 267.413 3.421 70 20 CGID Cc1c(F)cccc1NC(=O)C[C@@H]1CSCCS1 159616717 XUAANXLVHOMBTN-SNVBAGLBSA-N 285.409 3.311 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccnn1Cc1ccccc1 159845024 VPBNSEINBRJWPY-WMLDXEAASA-N 283.375 3.306 70 20 CGID CC(C)CCOCC[C@H](C)CCS(=O)(=O)Cl 114672124 KXFUFHXZLRSTHX-NSHDSACASA-N 270.822 3.034 70 20 CGID CC(C)c1ccc(C(=O)N[C@H](C)c2cccnc2)cn1 161057363 QTKUMZNILGFCSH-GFCCVEGCSA-N 269.348 3.091 70 20 CGID Cc1ccsc1CCCC(=O)Nc1nccs1 160030899 DMPZLJJYCCUWBF-UHFFFAOYSA-N 266.391 3.474 70 20 CGID COc1cccc(NC(=O)N2CC[C@@H]3CCCC[C@@H]32)c1 160046383 IZUWWOWVIDMWLV-WFASDCNBSA-N 274.364 3.492 70 20 CGID C[C@@H]1CCN(C(=O)Nc2cnc(C(C)(C)C)nc2)C[C@@H]1C 160382645 ICKBBNAONXQHOU-NEPJUHHUSA-N 290.411 3.284 70 20 CGID C[C@@H](CC(=O)N1CCN(C)c2ccccc21)c1ccncc1 160545248 CIMKFDOIHFEDID-AWEZNQCLSA-N 295.386 3.058 70 20 CGID CCCCSCCC(=O)N(C)c1ccc2c(c1)OCO2 160643098 GRHACMZWTLQQJS-UHFFFAOYSA-N 295.404 3.302 70 20 CGID CCOC[C@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160933202 KXQPLNLDAOCOPS-ZDUSSCGKSA-N 267.413 3.088 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](C)C2CCOCC2)C1 159457467 VJUIPOWYZPMHNC-NWANDNLSSA-N 271.470 3.455 70 20 CGID COCC[C@@H](C)NC(=O)CCCOc1ccc(C)cc1C 159717842 ABRRQRZPFRTTIF-OAHLLOKOSA-N 293.407 3.004 70 20 CGID Cc1ccccc1[C@@H](C)NCCCc1cnn(C)c1 159423025 FKSQFPXMXDZJFE-CQSZACIVSA-N 257.381 3.012 70 20 CGID CC[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)C(=O)OC 159513721 FFSZZRJEONIMIV-CABZTGNLSA-N 289.297 3.308 70 20 CGID c1ccc2c(CNC3CCN(C4CC4)CC3)coc2c1 159815579 GFCMXMKHYWDVES-UHFFFAOYSA-N 270.376 3.149 70 20 CGID CC[C@@H](NCC1(CO)CCCC1)c1ccc(OC)cc1 160118793 XSFJULAVNISIEC-MRXNPFEDSA-N 277.408 3.289 70 20 CGID COc1cccc(CCNCc2cc(F)cc(F)c2)c1 160183501 IJMALFYVCPCNNJ-UHFFFAOYSA-N 277.314 3.306 70 20 CGID C1CN[C@H](c2noc(C3C4CC5CC(C4)CC3C5)n2)C1 160249315 ZRCKXFODYDOARP-QBBLGZLKSA-N 273.380 3.034 70 20 CGID Cc1ccc(C(=O)Cn2c(C)nc3c2CCCC3)cc1 216887756 UIEGEMIXLNCTKY-UHFFFAOYSA-N 268.360 3.262 70 20 CGID COc1ccc(NC(=O)[C@@H](C)CC2CCCC2)cc1N 161136338 HEQHAWCJOQMVHN-NSHDSACASA-N 276.380 3.432 70 20 CGID CCCn1c(C)nnc1COc1ccccc1Cl 161183030 SZKWNOYELITFFJ-UHFFFAOYSA-N 265.744 3.229 70 20 CGID COc1ccc(NC(=O)Cc2nc(C)sc2C)c(C)c1 161259210 SDICESVQJUXGHW-UHFFFAOYSA-N 290.388 3.258 70 20 CGID CCC1(CC)[C@@H](N[C@@H](C)c2ccncc2)C[C@@H]1OC 160102218 CKXOETHGQDDVAP-QEJZJMRPSA-N 262.397 3.326 70 20 CGID COCCC[C@H](C)C(=O)N[C@@H]1CCCc2sccc21 160240037 JKNFAKGQNJSKPH-WCQYABFASA-N 281.421 3.304 70 20 CGID COC[C@@H](NCCCc1nc2c(s1)CCCC2)C(C)C 160623157 CLSRVWWGEKOYCZ-CQSZACIVSA-N 296.480 3.215 70 20 CGID Cc1ccc(C)c([C@@H]2CCCN2C(=O)CN(C)C(C)C)c1 160707917 VLNCECZCBDPQGM-KRWDZBQOSA-N 288.435 3.307 70 20 CGID COC(=O)c1csc(NC(=O)N2C[C@@H](C)C[C@H](C)C2)c1 160772417 CTQGLGXBFRIZSH-UWVGGRQHSA-N 296.392 3.045 70 20 CGID CC[C@@H](C)c1cc(C(=O)N(Cc2cccnc2)C2CC2)on1 159774555 UMZKWGQKZRGYOV-GFCCVEGCSA-N 299.374 3.388 70 20 CGID Cc1cccc(C)c1CNC1CCN(C(C)C)CC1 160413376 RYXFHZRONMCDPV-UHFFFAOYSA-N 260.425 3.266 70 20 CGID CC(C)[C@H](CCO)NC(=O)CCCC1CCCCC1 160556976 QGJSNBIGJGJZRQ-HNNXBMFYSA-N 269.429 3.260 70 20 CGID Cc1nc2ccccc2nc1N[C@@H](CO)CC(C)(C)C 161420232 VOCGGHICZGKOLE-GFCCVEGCSA-N 273.380 3.147 70 20 CGID COc1cc(C)ccc1[C@H](C)N[C@H]1CCN2CCCC[C@@H]12 218130286 JUXKBJODIHYYCZ-XIRDDKMYSA-N 288.435 3.281 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2cc(C)on2)n1 159886352 PKVRJONTWWTADK-HNNXBMFYSA-N 257.337 3.024 70 20 CGID CC(C)CCN(C)c1ccncc1Br 159958398 YBBFHVUQTDISMY-UHFFFAOYSA-N 257.175 3.326 70 20 CGID COC(=O)[C@H](NCc1cccc2cc[nH]c12)c1ccccc1 161037950 IDVTXDFZDGTNIK-QGZVFWFLSA-N 294.354 3.172 70 20 CGID CCOc1cc(NC(=O)N[C@@H](C)C2CCC2)ccc1OC 161285264 DXFUAOFEWDQMGV-NSHDSACASA-N 292.379 3.404 70 20 CGID C[C@@H]1CN(C)[C@H](C)C[C@H]1NCC1(c2ccc(F)cc2)CC1 161359669 UXPCPICRXBWRLF-CKEIUWERSA-N 290.426 3.176 70 20 CGID CCCCOCC(=O)N(C)c1ccc(OC)c(Cl)c1 160051704 TWQFASKLMYHFON-UHFFFAOYSA-N 285.771 3.128 70 20 CGID Cc1nc(N)sc1-c1nc([C@H]2CCCCS2)no1 160646583 XZCAQWCDWCEKRP-SSDOTTSWSA-N 282.394 3.042 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H]2CC=CCC2)n1 160940252 UEQUEVKHDFVZEP-LBPRGKRZSA-N 296.374 3.329 70 20 CGID CN(C)c1ccncc1CN[C@H]1CCCc2sccc21 160993815 MOIBMSTVEDDBGQ-AWEZNQCLSA-N 287.432 3.376 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@@H]1c1cccc(F)c1F 159862410 YURAXBQQPYYTMP-OLZOCXBDSA-N 291.341 3.375 70 20 CGID COc1ccccc1[C@@H](C)CC(=O)NCC1(C2CC2)CC1 159885117 URXYBHHFLKFXFU-ZDUSSCGKSA-N 287.403 3.495 70 20 CGID CC[C@H](NC(=O)c1ccc(OC)cc1)c1c(C)noc1C 159995325 HRWYBBPVRVYORC-AWEZNQCLSA-N 288.347 3.181 70 20 CGID Cc1ccc(C(=O)CCN(C)Cc2nccs2)cc1 159945624 GMLRMJNVUHZXEJ-UHFFFAOYSA-N 274.389 3.156 70 20 CGID CCC[C@@H](NCc1ccc(OC)c(Cl)c1)C(=O)OCC 160459459 OXVYVCZYRQBVBY-CYBMUJFWSA-N 299.798 3.170 70 20 CGID Cc1cccc(C(=O)N[C@@H](CN)C2CCCCC2)c1Cl 160403128 WSYNKAHMDNFPCP-AWEZNQCLSA-N 294.826 3.286 70 20 CGID CC1CCN(CCCNCc2cccc3cc[nH]c23)CC1 218079146 DRDZQHWBCPXKOA-UHFFFAOYSA-N 285.435 3.380 70 20 CGID Cc1nc(-c2ccccc2NC(=O)[C@H]2CCCO2)cs1 218570141 NSWIQJOUAXYIMB-CQSZACIVSA-N 288.372 3.236 70 20 CGID CCCCOCCCNc1nc(CCC)ns1 160369210 ASGWYDZVMRKJIN-UHFFFAOYSA-N 257.403 3.109 70 20 CGID CC1CCN(C(=O)N[C@@H](C)c2ccsc2)CC1 160525336 FCQJIYBPDDVWTP-NSHDSACASA-N 252.383 3.251 70 20 CGID CCCC1(CNc2ccc(C(=O)OC)c(C)n2)CC1 218068523 GBFSAIQWNPHUBW-UHFFFAOYSA-N 262.353 3.169 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccnc1OC 161161051 PZCTZJZDODRZOB-TZMCWYRMSA-N 276.380 3.131 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1coc(Br)c1 161459727 NWKBIZGCJGWDQU-OCAPTIKFSA-N 272.142 3.055 70 20 CGID CC(C)Oc1ccc(CN[C@H](C)c2cncc(F)c2)cn1 160087882 CJJLGYHVRAXNGS-GFCCVEGCSA-N 289.354 3.254 70 20 CGID CSC[C@H](C)C(=O)N[C@@H]1CCCc2sccc21 160190483 ZYFRFZMXAIQQLU-GXSJLCMTSA-N 269.435 3.241 70 20 CGID C[C@H](C(=O)O[C@@H](c1ccccn1)C(F)(F)F)C1CC1 160250239 DIRBVVQZQWEEEY-KWQFWETISA-N 273.254 3.274 70 20 CGID CCC(CC)C(=O)N[C@@H](CC)c1c(C)noc1C 160419161 UIWSGTRKQTXLMM-LBPRGKRZSA-N 252.358 3.295 70 20 CGID COc1ccccc1CN(C)Cc1cnn(C(C)(C)C)c1 160426328 ZEIPANYWAOTRPG-UHFFFAOYSA-N 287.407 3.279 70 20 CGID COc1ccc(C(C)(C)C(=O)Nc2ccccc2O)cc1 160529862 HDYNQDOJFCHXPN-UHFFFAOYSA-N 285.343 3.317 70 20 CGID CC[C@H](NC[C@H]1CCOC1)c1ccc(F)cc1F 160820096 ALSMMTLMQIURQA-YGRLFVJLSA-N 255.308 3.042 70 20 CGID Cc1nn(C)c(C)c1OCc1noc(C2CCCCC2)n1 160905539 FVSJVPZQUOEVAJ-UHFFFAOYSA-N 290.367 3.047 70 20 CGID CC[C@H](C(=O)NC[C@]1(C)CCCO1)c1ccc(F)cc1 160946580 HUWFJOMCTKEQSK-HOCLYGCPSA-N 279.355 3.005 70 20 CGID CSc1ccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)o1 159631037 SXCWSDNMDXSWHS-LLVKDONJSA-N 295.404 3.223 70 20 CGID COc1ccc(CN(C)Cc2cnc3ccc(C)cn23)cc1 159875201 FWIUMJQCSBJPHE-UHFFFAOYSA-N 295.386 3.283 70 20 CGID Cc1cc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)ccc1F 159533119 HOBOMRSTCUHFCX-KBMXLJTQSA-N 275.367 3.181 70 20 CGID COc1cccc2sc(NC(=O)C3=CCCC3)nc12 159543831 XTICGFZHJOVOIJ-UHFFFAOYSA-N 274.345 3.354 70 20 CGID CN(C)C1(CNCc2ccc(Cl)cc2F)CCCC1 160880338 URNJODVPOYQIEK-UHFFFAOYSA-N 284.806 3.443 70 20 CGID NC(=O)c1cccc(NCc2cc(F)cc(Cl)c2)c1 160814720 CDRLHZIBNPFCAM-UHFFFAOYSA-N 278.714 3.190 70 20 CGID C[C@H](c1ccc(Br)cc1)S(=O)(=O)Cl 88251080 OJEMMCVJACBAPY-ZCFIWIBFSA-N 283.574 3.079 70 20 CGID CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)C1 218509600 WQUOIEJDDVWIAZ-LBPRGKRZSA-N 263.337 3.117 70 20 CGID CC(C)Oc1cncc(C(=O)Nc2cc(Cl)ccn2)c1 161166539 DFCZBGDKCJGFPT-UHFFFAOYSA-N 291.738 3.170 70 20 CGID Cc1nc(CN2c3ccccc3S[C@@H](C)[C@@H]2C)no1 161253538 FQHXNTBCBXYWQF-UWVGGRQHSA-N 275.377 3.267 70 20 CGID CO[C@@]1(C)C[C@H](N(C)C(=O)Nc2ccc(C)nc2)C1(C)C 161324397 VBKWTVUYWHGNIH-BBRMVZONSA-N 291.395 3.057 70 20 CGID Cc1c(C(=O)NCC2(CO)CCCC2)oc2ccccc12 160276855 CTZVZKYOJVQQBH-UHFFFAOYSA-N 287.359 3.024 70 20 CGID CC[C@H](CN[C@H]1CCN(C)[C@H](C)C1)Oc1ccccc1F 160305126 DBPAPNUZBTXZBM-QLFBSQMISA-N 294.414 3.055 70 20 CGID CCOc1ccccc1CN(C)Cc1cnc2ccccn12 160424703 NLGFPYQXPGCUTI-UHFFFAOYSA-N 295.386 3.365 70 20 CGID CN(CCC(F)(F)F)C(=O)CCc1ccc(F)cc1F 160898147 IOPDBBPKKMCQEL-UHFFFAOYSA-N 295.251 3.308 70 20 CGID Cc1ccc(C[C@H](C)NC(=O)c2cccc3[nH]cnc23)s1 159626219 NWRLYOCUFHXTRK-JTQLQIEISA-N 299.399 3.294 70 20 CGID CO[C@@H](C)CC(=O)N1C[C@@H](C)CSc2ccccc21 159633968 JLNXWZQEBNQATE-NEPJUHHUSA-N 279.405 3.186 70 20 CGID Cc1ccc(N2CC[C@@H](Sc3ccncc3)C2=O)cc1 159874303 NAVFNJRWMNFQCP-OAHLLOKOSA-N 284.384 3.288 70 20 CGID Cc1cccnc1[C@@H](NC(=O)CCCn1cccc1)C(C)C 159555648 RGDNGFMXEDIXDH-KRWDZBQOSA-N 299.418 3.485 70 20 CGID COc1cc(N[C@H]2CCO[C@@H](C(C)C)C2)ccc1F 160080339 ZHTBFFVMGYDWLL-GXTWGEPZSA-N 267.344 3.450 70 20 CGID CCn1ccnc1CN(Cc1ccccc1)C1CC1 160747666 MZHMBZBYOWQLFU-UHFFFAOYSA-N 255.365 3.068 70 20 CGID CCOC(CCCNCc1cc(F)cc(F)c1)OCC 159614297 MLWJCBGQVIGTQL-UHFFFAOYSA-N 287.350 3.234 70 20 CGID O=C(NCc1ccc2ccccc2c1)[C@H]1CCCCO1 161032286 CKNWYBGHPSDMJW-MRXNPFEDSA-N 269.344 3.025 70 20 CGID COc1ccc(NC(=O)C[C@@H]2CC[C@H](C)C2)cc1N 161249239 POBFBBAMAOZFLM-WDEREUQCSA-N 262.353 3.042 70 20 CGID CCCn1cc(C(=O)N[C@@H]2CCCc3sccc32)cn1 160013688 PCSRIINOBXEWPK-CYBMUJFWSA-N 289.404 3.162 70 20 CGID C[C@@H](CCOc1ccccc1)C(=O)NCC1(C2CC2)CC1 160103153 YYAIJXAJQCDZTA-AWEZNQCLSA-N 287.403 3.398 70 20 CGID Cc1noc(C)c1CCSCc1nc(C(C)(C)C)no1 160126613 SZKOCHLSDHJSGS-UHFFFAOYSA-N 295.408 3.448 70 20 CGID O=C(N[C@@H]1CCSc2ccc(F)cc21)[C@H]1CCCCO1 160290797 RDFYBCDABKCHLD-CHWSQXEVSA-N 295.379 3.048 70 20 CGID Cc1ccc(C(=O)C(=O)N[C@@H]2CCCc3sccc32)cc1 160448737 RVMGPEQGMQBKGT-CQSZACIVSA-N 299.395 3.433 70 20 CGID COC(CN1CCC[C@H]1c1cccc(Cl)c1)OC 160619144 KZILWRQRDLSFGI-ZDUSSCGKSA-N 269.772 3.096 70 20 CGID CC1=C(C(=O)N2CCC[C@@H]2c2cccs2)CCCO1 159468574 PFVZRLWEAXYPQL-CYBMUJFWSA-N 277.389 3.496 70 20 CGID Cc1cc(C(=O)N2C[C@@H](C)CSc3ccccc32)on1 159487081 BZYTWZONIOZKHH-SNVBAGLBSA-N 288.372 3.372 70 20 CGID CCC(C)(CC)C(=O)Nc1ccc2c(c1)N(C)CC2 159526573 NAHDBFZRPLIQPM-UHFFFAOYSA-N 260.381 3.444 70 20 CGID CCC1(CNC(=O)NC[C@H](C)c2c(C)noc2C)CCC1 159549837 KYFRXZBUHZRXSZ-NSHDSACASA-N 293.411 3.274 70 20 CGID COc1ccc(N(C)C(=O)CCc2ccoc2)cc1F 159791590 BCGGMHFGZUETMK-UHFFFAOYSA-N 277.295 3.023 70 20 CGID COc1cc2c(cc1CNC1(C)CCC1)O[C@H](C)C2 159927875 YMJJQCQGSDBXQN-LLVKDONJSA-N 261.365 3.051 70 20 CGID CCc1ncnc(NCc2sccc2C)c1F 217991731 YOHJLZRNERJQOQ-UHFFFAOYSA-N 251.330 3.160 70 20 CGID Cc1ccc(CN(C)CCOc2ccc(F)cc2)nc1 160328110 JWSQGCXBBBKZMT-UHFFFAOYSA-N 274.339 3.040 70 20 CGID CC1CCN(C(=O)N[C@H](C)c2ccsc2)CC1 160525465 FCQJIYBPDDVWTP-LLVKDONJSA-N 252.383 3.251 70 20 CGID C[C@@H]1CCC[C@@H](CNCc2nn(C)c3ccccc23)C1 218135105 BMJNUCDHDYHWKO-ZIAGYGMSSA-N 271.408 3.489 70 20 CGID CC(=O)NC1CCC(Nc2cc(C)cc(C)c2)CC1 161081494 KPDMXDZGPLMMLU-UHFFFAOYSA-N 260.381 3.163 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CCc1cccnc1 161295896 VTBBACWKFZDMDA-CVEARBPZSA-N 274.408 3.441 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)NCC1(C2CC2)CC1 161375739 SMFDKYRYEOKAML-JTQLQIEISA-N 276.380 3.091 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccccc1 161414411 HZSPUWKXQZLRID-ZBFHGGJFSA-N 295.448 3.019 70 20 CGID CN1CCC(N[C@H]2CC(C)(C)Oc3cc(F)ccc32)CC1 161475138 GPCWERTZWQGLLW-HNNXBMFYSA-N 292.398 3.112 70 20 CGID CCOc1cc(Cl)ccc1NC(=O)[C@H]1CCC[C@H](N)C1 161501885 XMNHZNFAAQDCTG-JQWIXIFHSA-N 296.798 3.195 70 20 CGID CCCC(O)(CCC)CC(=O)NC[C@H]1Cc2ccccc21 160115254 FFIHOPZHFPFBEM-OAHLLOKOSA-N 289.419 3.164 70 20 CGID COc1ccc2oc(-c3nc4ccncc4[nH]3)cc2c1 160270943 ZPJURDMXXQAMST-UHFFFAOYSA-N 265.272 3.380 70 20 CGID CC(C)c1nsc(N2CCC[C@@H]2CN2CCCCC2)n1 160429543 LJHROYXGSCMPOL-CYBMUJFWSA-N 294.468 3.116 70 20 CGID COC[C@@H]1CCCN1C(=O)C[C@@H](C)c1ccc(F)cc1F 160882920 ZAYHBKQPKICQER-YPMHNXCESA-N 297.345 3.096 70 20 CGID CC[C@@H](Nc1nc(C(C)(C)C)ns1)c1noc(C)n1 159800671 XNFJSPPHQWYYIP-MRVPVSSYSA-N 281.385 3.090 70 20 CGID CC[C@@H]1CCN(C(=O)c2cnn(CC(C)C)c2C2CC2)C1 159430061 JAHOLLHCASZAAO-CYBMUJFWSA-N 289.423 3.289 70 20 CGID Cc1ccccc1[C@@H]1C[C@H]1C(=O)NCC1(C2CC2)CC1 159861297 COLDITOEMDDLTN-JKSUJKDBSA-N 269.388 3.405 70 20 CGID CCOc1ccc(NC(=O)N[C@@H](C)C2CCC2)cc1OC 159710741 MYDKKSITCKXADV-NSHDSACASA-N 292.379 3.404 70 20 CGID CCC(C)(CC)C(=O)NCc1ccnc(OC(C)C)c1 159362608 BVDVPKNVKLRGSH-UHFFFAOYSA-N 278.396 3.311 70 20 CGID CC[C@@H](NC(=O)c1cc(Cl)ccn1)c1c(C)noc1C 159951836 ZWTAFPHPRUUIDJ-LLVKDONJSA-N 293.754 3.221 70 20 CGID CC[C@H](CSC)N(C)c1nc(Cl)cs1 160140988 JXHVITIQJOEBQN-SSDOTTSWSA-N 250.820 3.374 70 20 CGID Cc1cccc(C)c1CN[C@](C)(CO)c1ccccc1 217731489 QVRQUAVGGTXUIA-GOSISDBHSA-N 269.388 3.301 70 20 CGID CCc1ccc(CNc2ccc(C(=O)OC)c(C)n2)s1 217973572 IZADBLVWFIVCNE-UHFFFAOYSA-N 290.388 3.413 70 20 CGID Cc1nc(CCNCc2cccc3[nH]ccc23)cs1 218098751 AAAOZXPBTNWSJJ-UHFFFAOYSA-N 271.389 3.265 70 20 CGID C1CCC(C2CCN(CC3CCNCC3)CC2)CC1 217122277 BLXGDSDRQRVBJB-UHFFFAOYSA-N 264.457 3.278 70 20 CGID CC(C)(O)Cn1cc(-c2ccc(Br)cc2)cn1 218010804 HUBKCTONAZNNQO-UHFFFAOYSA-N 295.180 3.084 70 20 CGID Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)CCNC(C)C)C1 161290390 PXTLFUZGHCQTJU-CVEARBPZSA-N 288.435 3.088 70 20 CGID O=C(Nc1ccccc1OCc1nccs1)C1CC1 161356529 FKCLTXKFRPTJMO-UHFFFAOYSA-N 274.345 3.071 70 20 CGID Cc1ccc(C(=O)CCN2CCC(n3ccnc3)CC2)cc1 160065826 PZAYEZQBBOBOAF-UHFFFAOYSA-N 297.402 3.101 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1sccc1C 160155409 RNXLUEKNKALKHC-CYBMUJFWSA-N 287.384 3.482 70 20 CGID CC(C)NC(=O)c1ccccc1NCc1ccco1 160406034 KFFAHJAWJZVUCD-UHFFFAOYSA-N 258.321 3.030 70 20 CGID CC[C@@H](COC)NCCOc1cccc2ccccc12 160815887 XSGYRKNTQXMQDV-HNNXBMFYSA-N 273.376 3.233 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CSc1nncs1 160901673 FJMRXNPYTCDFFV-QWRGUYRKSA-N 299.465 3.057 70 20 CGID Cc1nc2c(s1)[C@@H](N[C@H]1CCCSC1)CCC2 159619980 PYIPMHCGDRCGQQ-JQWIXIFHSA-N 268.451 3.314 70 20 CGID CC(C)[C@@H]1CN(C(=O)[C@@H]2CCCCO2)c2ccccc2N1 159812226 YTJLLZSOGUVKIE-HOCLYGCPSA-N 288.391 3.039 70 20 CGID Cc1nccc(NC(=O)N2CC[C@@H](C)[C@H]2C)c1Cl 159647952 JWBPCPWZSRNYPK-PSASIEDQSA-N 267.760 3.306 70 20 CGID CCOCc1ccc(NC(=O)N(C)CCC2CC2)cc1 159453714 IHWVSCJHDYGUJN-UHFFFAOYSA-N 276.380 3.487 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(CCOC)Cc1ccccc1 159475119 IFRLTPHDHVIXBS-RDJZCZTQSA-N 275.392 3.098 70 20 CGID CC(C)[C@H]1CN(c2nc(C(C)(C)C)ns2)CCS1 159755905 PNVTVGFWBHEXSH-SNVBAGLBSA-N 285.482 3.413 70 20 CGID Cc1noc(C)c1C[C@H](C)Nc1nc(C(C)(C)C)ns1 159569322 PQLJMXZCRKZEFL-QMMMGPOBSA-N 294.424 3.484 70 20 CGID CC[C@@H](O)CN(Cc1ccccc1)c1ccnc(C(C)C)n1 161010764 JVLKEZMCGIIVCY-MRXNPFEDSA-N 299.418 3.378 70 20 CGID CC(C)(C)CCOCC(C)(C)CS(=O)(=O)Cl 116968302 QVWUUOTXFONPPJ-UHFFFAOYSA-N 270.822 3.034 70 20 CGID CC(C)(C)CCCCNC(=O)CN1CCCCCCC1=O 216893215 OCQNSAXZXUIMLX-UHFFFAOYSA-N 296.455 3.112 70 20 CGID Cc1cc(C)cc(OCCC(=O)O[C@H](C)C2CC2)c1 216868307 ZWUUJWGPFLVAQE-CYBMUJFWSA-N 262.349 3.414 70 20 CGID Cc1ccc(NC(=O)NCCC2CCCCC2)cn1 217305278 SAWHAFMAEOQTOV-UHFFFAOYSA-N 261.369 3.482 70 20 CGID Cc1ccc(NCc2nnc3n2CCCC3)c(Cl)c1 217317832 QYWTVBGMNMDBHS-UHFFFAOYSA-N 276.771 3.188 70 20 CGID Cc1cccc([C@@H](O)Cn2c(C)nc3c2CCCC3)c1 216919658 FBFPUIWYBOLETK-KRWDZBQOSA-N 270.376 3.112 70 20 CGID Cc1cc2cc(C(=O)N[C@@H]3CCC[C@@H](N)C3)oc2cc1C 161447739 ZXNLHVKIXXBZPE-ZIAGYGMSSA-N 286.375 3.049 70 20 CGID Cc1cccc([C@H](C)NC(=O)[C@H]2CCC(=O)C[C@@H]2C)c1C 160097158 UCMQGLQLPJPZSC-NOLJZWGESA-N 287.403 3.486 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@@H]1CCCOC1 160187412 DHVJCWIWFATLSQ-QWHCGFSZSA-N 278.348 3.034 70 20 CGID C/C=C(\C=C\C(=O)NC[C@H](O)c1ccccc1C)CC 160460617 QHTRUARFRKOMSO-WWKAMFKXSA-N 273.376 3.057 70 20 CGID COc1ccc(C[C@H](C)C(=O)NC[C@@H]2CC=CCC2)cc1 160707737 BLIOLLROSIOSCJ-GOEBONIOSA-N 287.403 3.346 70 20 CGID CC(C)C[C@@H]1CCCCN1C(=O)C[C@@H](C)[C@@H]1CCCNC1 160874960 ZEYOFDRMHQTHPY-ZACQAIPSSA-N 294.483 3.439 70 20 CGID Cc1nccc(CNC(=O)C[C@H]2CCCCC2(C)C)n1 159818717 KAFWRSWQNILZKR-CYBMUJFWSA-N 275.396 3.008 70 20 CGID CC1(NC(=O)NCCc2ccc(Cl)s2)CCC1 159454869 YARQNMNPHCJWOG-UHFFFAOYSA-N 272.801 3.186 70 20 CGID Cc1ccc(O)c(NC(=O)c2ccn(C3CCCC3)n2)c1 159655497 XFSOZGBWANTOEB-UHFFFAOYSA-N 285.347 3.265 70 20 CGID CCC(C)(C)C(=O)N(C)c1ccc(OC)c(F)c1 159765115 UYPCUJXBWHADIJ-UHFFFAOYSA-N 253.317 3.233 70 20 CGID COc1ccc(C)cc1N[C@H](C)CCn1cccn1 159391033 KHTJFHKUPLDKHL-CYBMUJFWSA-N 259.353 3.091 70 20 CGID CCOc1ccccc1[C@@H](C)NCC1(CO)CCCC1 160069134 CKQKGUGLRXYWSJ-CQSZACIVSA-N 277.408 3.289 70 20 CGID CC[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccccc1OC 218117937 AGSATQVYNNLVHQ-BBWFWOEESA-N 288.435 3.363 70 20 CGID COc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C)cc1N 161292903 MZWRUEBKUKWJMT-LSDHHAIUSA-N 296.370 3.328 70 20 CGID COc1ccc(CC[C@@H](C)NC(=O)C[C@H](C)SC)cc1 161390006 ZXFXFRMOVZKJTM-OLZOCXBDSA-N 295.448 3.274 70 20 CGID C[C@H]1C[C@H](C)CN(C(=O)COc2ccc3[nH]ccc3c2)C1 160074247 VBLMJMTXVJGAQC-STQMWFEESA-N 286.375 3.051 70 20 CGID C[C@@H](NC(=O)c1cncc(-c2ccccc2)c1)C1CC1 160106698 ADPAWRVZCJABBF-GFCCVEGCSA-N 266.344 3.277 70 20 CGID Cc1nc(-c2ccc(CNC(=O)C3(C)CC3)o2)cs1 160154644 SHGKJWDQSPFRFA-UHFFFAOYSA-N 276.361 3.128 70 20 CGID O=C(NCCOc1ccccc1Cl)N[C@@H]1C=CCCC1 160268695 HEKVYBDWMWCZTI-GFCCVEGCSA-N 294.782 3.127 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)N[C@@H]1CCCc2sccc21 160385416 KFDDLFVEHHIAHK-VHRBIJSZSA-N 291.416 3.247 70 20 CGID CCOCCC1(C(=O)N2C[C@@H](C)C[C@H](C)C2)CCC1 160517836 QNUYDLFWAUSFTK-KBPBESRZSA-N 267.413 3.088 70 20 CGID C[C@@H]1C[C@@H]1CN[C@@H](CN)c1ccc2ccccc2c1 160684997 WVZXQEOMYCYJOE-JLZZUVOBSA-N 254.377 3.085 70 20 CGID C[C@@H]1CCC[C@@H](CC(=O)N(C)Cc2cccn2C)C1 160713106 CVJNDZQYGXGAAO-ZIAGYGMSSA-N 262.397 3.200 70 20 CGID CCCOc1cccc(CC(=O)Nc2cccc(F)n2)c1 160719532 PLQLGOHLZDMIHY-UHFFFAOYSA-N 288.322 3.191 70 20 CGID CC1(NC(=O)N[C@H]2CCN(C3CCCC3)C2)CCCCC1 160874298 OCVNWNFQMFZWPH-AWEZNQCLSA-N 293.455 3.025 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1ccc(OC)cc1OC 159494072 DMAXDIIQHHTEKL-PBHICJAKSA-N 291.391 3.098 70 20 CGID CC[C@H]1CN(C(=O)Nc2ccnc(C)c2Cl)C[C@H](C)O1 159902620 VYMIOFCHMHCWHP-ONGXEEELSA-N 297.786 3.075 70 20 CGID CO[C@]1(C)C[C@@H](N(C)C(=O)c2cc(C(C)C)on2)C1(C)C 159747769 KZDUMBHLSJECLB-CZUORRHYSA-N 294.395 3.074 70 20 CGID CCCn1nccc1CNc1ccc(F)c(OC)c1 160113893 UUZDUAPUIUKBRD-UHFFFAOYSA-N 263.316 3.053 70 20 CGID c1ccc2c(c1)NC[C@@H]2c1nc([C@@H]2CCCS2)no1 160588049 ZYQZRJIKILCQGS-JQWIXIFHSA-N 273.361 3.195 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)Cc1ccc(F)c(F)c1 160937008 GAOCNELRDZJVJU-NHYWBVRUSA-N 267.319 3.359 70 20 CGID CCOCCCNC(=O)Nc1ccc(C(F)(F)F)cc1 217312845 IMXYNXDQMGOUEJ-UHFFFAOYSA-N 290.285 3.254 70 20 CGID C[C@H](CC1CC1)NCc1cncc(Br)c1 160578380 CCZPHCBUTDNIDU-SECBINFHSA-N 269.186 3.122 70 20 CGID CC[C@H](C)OCC(CC)(CC)CS(=O)(=O)Cl 114473785 ZFHXDJHUSANBPM-JTQLQIEISA-N 270.822 3.177 70 20 CGID CC[C@@H]1CCC[C@@H](NC(=O)NCCc2ccncc2C)C1 161463415 YNMNERWEGVBQLM-GDBMZVCRSA-N 289.423 3.201 70 20 CGID CCCNC(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F 161501296 FKKUTXPVZWLFQN-NSHDSACASA-N 290.285 3.008 70 20 CGID CC[C@@H](C)N(Cc1ccccc1)C(=O)[C@H]1CCCCO1 160055557 WLMIMYCCVXTGAC-GDBMZVCRSA-N 275.392 3.383 70 20 CGID COc1ccc(CC[C@@H](C)NC(=O)NC2(C)CCC2)cc1 160219129 KFVITBWLBZMGBZ-CYBMUJFWSA-N 290.407 3.258 70 20 CGID CCCC1(CNC(=O)NC[C@H](C)c2c(C)noc2C)CC1 160333596 RPMKPUWUECBJJT-NSHDSACASA-N 293.411 3.274 70 20 CGID C[C@@H](N[C@@H]1CCCSC1)c1ccc(F)cc1N(C)C 159622777 LIWNNUSKPUBIRU-DGCLKSJQSA-N 282.428 3.438 70 20 CGID C[C@@H](Nc1nc(C(C)(C)C)ns1)C(C)(C)CN(C)C 159635801 PREBWVITUDLKNO-SNVBAGLBSA-N 284.473 3.224 70 20 CGID Cc1nccc(NC(=O)N(C)CCC2CC2)c1Cl 159853350 HNZXQJCMSCZDTL-UHFFFAOYSA-N 267.760 3.307 70 20 CGID Cc1ccc(CNC(=O)Cc2c(C)noc2Cl)c(C)c1 159857077 PPOUGMZHIAGWQL-UHFFFAOYSA-N 292.766 3.112 70 20 CGID COc1ccc(Cl)c(N[C@@H](C)CCn2cccn2)c1 159487572 VTYWUKNIYMZGPY-NSHDSACASA-N 279.771 3.436 70 20 CGID Cc1cc(NC(=O)c2cc3ccccc3s2)c[nH]c1=O 159511114 WGGNCOIVJNYXRR-UHFFFAOYSA-N 284.340 3.150 70 20 CGID O=C(CCc1ccc(F)cc1)NCC1(C2CC2)CC1 159939080 IGAHBDUBBJGNRY-UHFFFAOYSA-N 261.340 3.065 70 20 CGID C[C@@H](O)CC(C)(C)CNc1nc(C(C)(C)C)ns1 159633774 VELMBHKLBQRVRT-SECBINFHSA-N 271.430 3.045 70 20 CGID Cc1cc(C)c(C(=O)NCc2ccc(O)cc2)c(C)c1 161046050 BNIVHXDMTBEFJC-UHFFFAOYSA-N 269.344 3.247 70 20 CGID COc1ccc([C@@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)cc1 161112425 RSAOBSSNCRNSLX-BMFZPTHFSA-N 276.424 3.219 70 20 CGID CCc1ncnc(N[C@@H]2CCCC[C@H]2SC)c1F 218034096 PXBMURQUXVQYDJ-GHMZBOCLSA-N 269.389 3.264 70 20 CGID CN(CCn1ccnc1)Cc1csc2ccccc12 159744399 KIHQOAZQASLFMZ-UHFFFAOYSA-N 271.389 3.230 70 20 CGID CCc1cccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1 161048281 WZLFAZOGOYLKGN-HZPDHXFCSA-N 288.391 3.328 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCc3cc(F)ccc32)cn1 161377744 IEXPBEXMYBMVBH-OAHLLOKOSA-N 285.322 3.338 70 20 CGID CC1(C)CCC(C(=O)N2CCC(n3ccnc3)CC2)CC1 160041694 NPQHWXKYTOQGRP-UHFFFAOYSA-N 289.423 3.263 70 20 CGID C[C@@H](Cc1ccccc1F)C(=O)NCc1cccc(O)c1 160226438 KLEITMRVYOJTLC-LBPRGKRZSA-N 287.334 3.026 70 20 CGID FC(F)(F)c1cccc(N[C@H]2CCO[C@@H](C3CC3)C2)n1 160297754 SZFKUITZZAKGJW-WDEREUQCSA-N 286.297 3.470 70 20 CGID CC[C@@H]1CCCN(C(=O)c2c(C(C)C)nn(C)c2Cl)C1 160319477 PBJDMSKPCPSHPV-LLVKDONJSA-N 297.830 3.459 70 20 CGID CC(C)c1ccc(OCCN[C@H]2CCN(C)[C@@H](C)C2)cc1 160326556 IRCIGAFNDRJOBH-RDJZCZTQSA-N 290.451 3.261 70 20 CGID Brc1ccc(N[C@H]2CCO[C@H](C3CC3)C2)nc1 160468845 YPGQFJURZVQSCN-RYUDHWBXSA-N 297.196 3.214 70 20 CGID CCc1ccccc1C(=O)NCCCN1CCC(C)CC1 160839399 XPAMADNESKMVKI-UHFFFAOYSA-N 288.435 3.101 70 20 CGID CN(C)Cc1ccnc(NC(=O)C2CCC(C)(C)CC2)c1 160976298 ULESMMUOGSRIBT-UHFFFAOYSA-N 289.423 3.298 70 20 CGID CC[C@H](C)OCC(=O)N1CCC[C@@H]1C1CCCCC1 159451052 VOIZVERIBQZIOK-DZGCQCFKSA-N 267.413 3.373 70 20 CGID CC[C@@H](C)OCC(=O)Nc1ccc(OC(F)F)c(F)c1 159380511 GKYWIKIVVXQWTE-MRVPVSSYSA-N 291.269 3.181 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cc(F)cc(F)c1 160111806 AQSLFMFPYNQDBF-NEPJUHHUSA-N 270.367 3.346 70 20 CGID O=C(CCl)N[C@H](Cc1ccccc1)c1cccs1 144282742 RAYABPVMNSKBCT-GFCCVEGCSA-N 279.792 3.387 70 20 CGID CC(C)Oc1ccc([C@H](C)NC(=O)[C@H]2CCCCO2)cc1 161081168 GOYNNZBNXUQFAH-XJKSGUPXSA-N 291.391 3.220 70 20 CGID CCCCS[C@@H](C)C(=O)Nc1ccc(OC)c(N)c1 161124469 GNZPRLOUSKZWEL-JTQLQIEISA-N 282.409 3.138 70 20 CGID C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)[C@@H]1CC=CCC1 161205201 DKAJFFSQYOHQSZ-TZMCWYRMSA-N 289.350 3.260 70 20 CGID Cc1sc2ncnc(NCC3(CO)CCCC3)c2c1C 160200762 JNYJZJZCJPDRDN-UHFFFAOYSA-N 291.420 3.273 70 20 CGID Cc1ccccc1OCCCC(=O)NCC1(C2CC2)CC1 160201008 HBQBKWAIJWLXOI-UHFFFAOYSA-N 287.403 3.460 70 20 CGID CC(C)[C@@H]1CCCCN1Cc1cnc2ccccn12 160485568 PXAPVUJVWDZCTQ-HNNXBMFYSA-N 257.381 3.345 70 20 CGID C[C@@H](C(=O)NCCc1csc(C(C)(C)C)n1)C1CC1 160755425 PRTRXYCVGQBGLQ-SNVBAGLBSA-N 280.437 3.145 70 20 CGID CC[C@@H](C)NC(=O)NOCc1ccc(C(F)(F)F)cc1 160977191 HKALDXDVEYXRKO-SECBINFHSA-N 290.285 3.235 70 20 CGID C[C@H](C[C@@H]1CCCO1)NC(=O)C1CCC(C)(C)CC1 159803228 LVBNUZQVNIIYPU-OCCSQVGLSA-N 267.413 3.277 70 20 CGID CC[C@H](OC(=O)CCCC(=O)OC)c1cccc(OC)c1 159689031 MCBFZSFRHIQSIC-AWEZNQCLSA-N 294.347 3.033 70 20 CGID CCc1ccccc1NC(=O)N[C@H](CC)[C@H]1CCCO1 159522862 JJONILMEGUYFMX-UKRRQHHQSA-N 276.380 3.328 70 20 CGID CCCCCOCC(=O)NCCc1cc2ccccc2[nH]1 159540301 XWFCCIQSHCCNNL-UHFFFAOYSA-N 288.391 3.033 70 20 CGID CC(C)(C)c1nsc(NCc2ccc(O)c(F)c2)n1 159576018 XBJDDCNGDULCJI-UHFFFAOYSA-N 281.356 3.292 70 20 CGID O=S(=O)(Cl)CCCSc1ccc(Cl)cc1 100495427 JIBGYKFCTXWJQG-UHFFFAOYSA-N 285.217 3.391 70 20 CGID CS[C@H](C)CNC(=O)c1cc2ccccc2cc1O 159437811 KMEDEOSPRNSVCN-SNVBAGLBSA-N 275.373 3.027 70 20 CGID C[C@H](O)CC(C)(C)CNc1nc(C(C)(C)C)ns1 159633629 VELMBHKLBQRVRT-VIFPVBQESA-N 271.430 3.045 70 20 CGID O=C(CNc1ccccc1)N[C@@H]1C[C@H]1C1CCCCC1 161065875 KWPAXILKCWTPSX-JKSUJKDBSA-N 272.392 3.184 70 20 CGID CCSCc1cccc(NC(=O)[C@@H](N)CC(C)C)c1 160421718 DNUQDJVPLUCLFQ-AWEZNQCLSA-N 280.437 3.252 70 20 CGID CC[C@@H](C)N(C)CCNCc1cnc(C(C)(C)C)s1 217394386 VEASLFWIYUGKIJ-GFCCVEGCSA-N 283.485 3.261 70 20 CGID CCOCCC1(CNC(=O)C(CC)CC)CCC1 161004101 ZXRMOFJQOVAIHF-UHFFFAOYSA-N 255.402 3.136 70 20 CGID COCCC1(CNC(=O)N(C)[C@H]2CCC[C@H](C)C2)CC1 161028149 KRGCZIDPPUAWMJ-KBPBESRZSA-N 282.428 3.023 70 20 CGID CCOCCC1(C(=O)N2CCc3ccccc32)CCC1 161043189 QKVYNHBSFVZABM-UHFFFAOYSA-N 273.376 3.173 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccc(F)cc2F)c1C 161218703 SHWPMURROBYQMM-UHFFFAOYSA-N 293.317 3.440 70 20 CGID CC[C@H](C)CN(CC)C(=O)C[C@H](C)c1ccncc1 161243951 SHVWMLPPQODNBM-KBPBESRZSA-N 262.397 3.470 70 20 CGID CC[C@H]1CCCC[C@H]1NCC(=O)N(C)Cc1ccccc1 161413244 DRJMBMAGCKWTIR-DLBZAZTESA-N 288.435 3.203 70 20 CGID CC[C@@H](NCCOc1c(C)cccc1C)[C@@H]1CCOC1 160277854 MPUCYLAILQVNBC-HZPDHXFCSA-N 277.408 3.087 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@H]1CSCCS1 160421608 FXYNAXQOLLSZKQ-ZYHUDNBSSA-N 299.486 3.090 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(-n2ccnc2)c(F)c1 160565287 NXXGMCNTSYODOA-JTQLQIEISA-N 293.367 3.092 70 20 CGID C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@H]1CCCCO1 160593241 LZTRHUSLKIQCRB-IINYFYTJSA-N 283.318 3.053 70 20 CGID CCC(=O)c1cccc(NC(=O)C2=C(C)OCCC2)c1 160646188 UGOFULFQBYLNPX-UHFFFAOYSA-N 273.332 3.302 70 20 CGID Cc1cc(C)c(C(=O)N[C@@H](C)CC(=O)c2cccs2)o1 160698795 LILOZWWZTOVPMC-JTQLQIEISA-N 291.372 3.349 70 20 CGID CC(C)CCn1ccc(NC(=O)NC[C@@H]2CC=CCC2)n1 160791634 MITNIVZRKDSQRN-CQSZACIVSA-N 290.411 3.407 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)Cc1ccc(F)c(F)c1 160936874 GAOCNELRDZJVJU-XHDPSFHLSA-N 267.319 3.359 70 20 CGID CC(C)CCC[C@@H](C)NC(=O)NOCc1cccnc1 160983395 JXQBPCZKMWBEGP-CYBMUJFWSA-N 279.384 3.027 70 20 CGID CC[C@@H](C)OCC(=O)NCc1cccc(OCC(C)C)c1 160986083 GQWCQLJMPKBMBT-CQSZACIVSA-N 293.407 3.153 70 20 CGID CC(C)[C@H](Cc1ccc(F)cc1)NCCC(C)(C)O 159623131 WYRDZCYAQQOUSY-HNNXBMFYSA-N 267.388 3.143 70 20 CGID Cc1noc(NC(=O)c2ccc(CCC(F)(F)F)cc2)n1 159886807 OLAJRIBNSFRPDE-UHFFFAOYSA-N 299.252 3.125 70 20 CGID C[C@@H](NCCCN1CCCCCC1=O)c1ccccc1 159554083 SBJZZYHILOCSIO-OAHLLOKOSA-N 274.408 3.130 70 20 CGID CCOc1ccccc1CN[C@H]1CCOC(C)(C)C1 160442969 CFVPTTRRYYTILW-AWEZNQCLSA-N 263.381 3.133 70 20 CGID CC1(C)C[C@@H](NCc2coc3ccccc23)CCO1 160616623 BKWVWIVAEUTYKV-ZDUSSCGKSA-N 259.349 3.480 70 20 CGID FCCCSCc1nc(-c2cccs2)no1 161205959 MHHZJUOTLFKYDY-UHFFFAOYSA-N 258.343 3.391 70 20 CGID CC[C@H](C)CN(CC)C(=O)C[C@@H](C)c1ccncc1 161243720 SHVWMLPPQODNBM-UONOGXRCSA-N 262.397 3.470 70 20 CGID COc1ccccc1CCC(=O)N1[C@@H](C)CC[C@H]1C 161426589 GLPBMQAUIHOESN-BETUJISGSA-N 261.365 3.027 70 20 CGID CC[C@@H](NC(=O)c1cccc(C)c1)c1c(C)noc1C 160052842 QZPJJYOGCWZBIF-CQSZACIVSA-N 272.348 3.481 70 20 CGID CC(C)(C)c1nsc(N[C@H]2[C@H]3CCO[C@@H]3C23CCC3)n1 160102642 WSRFLGZQBPLAKY-VWYCJHECSA-N 293.436 3.205 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)C1CCOCC1 160165021 KAKPNWNNCVRRQH-LBPRGKRZSA-N 278.348 3.034 70 20 CGID CC[C@H]1CCCC[C@@H]1NC(=O)c1cccc(-c2ncn[nH]2)c1 160257900 WEDABHOVPYDMLR-WFASDCNBSA-N 298.390 3.170 70 20 CGID CCOc1cccc([C@@H](C)NC(=O)NC2(C)CCC2)c1 160259468 YALWLJILMHXPIA-GFCCVEGCSA-N 276.380 3.388 70 20 CGID CCCC1(CNC(=O)c2cccc(CN(C)C)c2)CC1 160646685 WPAQIALVWNNEHI-UHFFFAOYSA-N 274.408 3.058 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)c1cc(Cl)c[nH]1 160729941 IPTPVQKORXFVBL-MRVPVSSYSA-N 296.779 3.121 70 20 CGID CCOCCC1(CNC(=O)c2ccc(C(C)C)nc2)CC1 159488169 XVGPSZQEOHJUKB-UHFFFAOYSA-N 290.407 3.142 70 20 CGID CC(C)CCNC(=O)[C@@H](C)N[C@@H](C)c1cccc(F)c1F 159508982 MPRBZGALQJZQAV-NWDGAFQWSA-N 298.377 3.166 70 20 CGID CSCCCCC(=O)N1CCC[C@H]1c1ccc[nH]1 159715736 WOXZLUBFLCKDEU-ZDUSSCGKSA-N 266.410 3.212 70 20 CGID COCC[C@H](C)NC(=O)CCCOc1ccc(C)cc1C 159717698 ABRRQRZPFRTTIF-HNNXBMFYSA-N 293.407 3.004 70 20 CGID COCCC1(CNC(=O)N[C@@H](C)c2ccccc2)CCC1 159521740 JEEJMJHFMWOIRI-AWEZNQCLSA-N 290.407 3.254 70 20 CGID COC(=O)[C@H](Sc1ccncc1)c1ccccc1 159971109 ADECLOVDSQBIKY-CYBMUJFWSA-N 259.330 3.088 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc2ccccc2[nH]1 159582002 RFASIZRSPDYMFH-YPMHNXCESA-N 256.349 3.476 70 20 CGID Cc1cccc(C)c1CNc1ccc(S(C)(=O)=O)cc1 160377230 CJUPDUQTVGICIV-UHFFFAOYSA-N 289.400 3.319 70 20 CGID Fc1cc(Cl)cc(CN[C@H]2CCN3CCC[C@@H]3C2)c1 160969909 QCXWSTHHNPPGKM-LSDHHAIUSA-N 282.790 3.196 70 20 CGID C[C@@]1(c2ccccc2)CC(=O)N(CC2CCCCC2)C1=O 217132355 ZFEFASPOZLXRIT-SFHVURJKSA-N 285.387 3.284 70 20 CGID CC[C@H](NCC(C)(C)N1CCC[C@@H](CC)C1)[C@@H]1CCOC1 161021802 MFERXAODZGCNQW-ZACQAIPSSA-N 296.499 3.292 70 20 CGID COc1ccc(Cl)cc1NC1CCC(NC(C)=O)CC1 161125329 HPMWCJBYLXZKBR-UHFFFAOYSA-N 296.798 3.208 70 20 CGID Cc1cc(NC(=O)N[C@@H]2CCCc3sccc32)no1 161181154 UNNFYMWBKXIKHP-SNVBAGLBSA-N 277.349 3.244 70 20 CGID CC(C)Cc1noc(CSCc2cscn2)n1 161287532 MTYFINMRHZLYQO-UHFFFAOYSA-N 269.395 3.158 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)N[C@H](C)CC(C)C 161297438 YUIFKIDNHGJXNA-GHMZBOCLSA-N 266.385 3.336 70 20 CGID CCSCC[C@H](C)N(C)C(=O)Nc1ccc(C)nc1 161324647 QOXYYVIIANHRTK-LBPRGKRZSA-N 281.425 3.385 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)cc1F 160196209 WRBSBDKSFKIJKI-CQSZACIVSA-N 291.366 3.356 70 20 CGID Cc1nc(CCNC(=O)N[C@H](C)CC(C)C)sc1C 160519922 DWTRTXFHENWOOY-SNVBAGLBSA-N 283.441 3.036 70 20 CGID CS[C@@H](C)CC(=O)N(C)c1ccc(C)cc1C 160557095 ZWJUXBGKJXYVMU-LBPRGKRZSA-N 251.395 3.408 70 20 CGID Cc1nccn1-c1ccc(NC(=O)[C@H]2CCC[C@@H](C)C2)cn1 160730740 RUIDTSYEFDBSBB-OCCSQVGLSA-N 298.390 3.341 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H](C)c2cnn(C)c2)C1 159408187 PWVKXXAVUWFKHC-YUTCNCBUSA-N 267.442 3.135 70 20 CGID Cc1ccc([C@H](C)NC(=O)NCCc2ccncc2C)cc1 159668150 SNEXRIVICFZOSQ-HNNXBMFYSA-N 297.402 3.301 70 20 CGID CN(C)C(=O)c1cccc(CN2CC[C@@H]3CCCC[C@@H]32)c1 159703410 LYIKJMCTMLOKJF-RDJZCZTQSA-N 286.419 3.153 70 20 CGID COC(=O)[C@H](Sc1ccncc1)c1ccccc1F 159914378 TVEXZKGMGLRFHT-CYBMUJFWSA-N 277.320 3.227 70 20 CGID CCCCn1ncc(NC(=O)N(C)[C@H](C)C2CC2)c1C 159742460 STXPMYNWMOVBIN-LLVKDONJSA-N 278.400 3.254 70 20 CGID Fc1cc(Cl)cc(CN[C@@H]2CCN3CCC[C@@H]3C2)c1 160969777 QCXWSTHHNPPGKM-HUUCEWRRSA-N 282.790 3.196 70 20 CGID CCN1CCC(CNCc2cc(F)cc(Cl)c2)CC1 160919939 KQEZHXGSYFHVGK-UHFFFAOYSA-N 284.806 3.301 70 20 CGID COc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)CC2 161041051 LVJSSZIPJCKBBH-RVKKMQEKSA-N 288.435 3.145 70 20 CGID CCCCN(CCOC)Cc1noc(C2CCCCC2)n1 161219558 QOARDERANQPAEE-UHFFFAOYSA-N 295.427 3.366 70 20 CGID COc1ccc(C(C)(C)CNC(=O)NC2(C)CCC2)cc1 160291530 IBKQYAPAGWHJJR-UHFFFAOYSA-N 290.407 3.215 70 20 CGID COCC(C)(C)C(=O)Oc1cccc(Br)c1 160493586 OJIRKMJGURKVOV-UHFFFAOYSA-N 287.153 3.027 70 20 CGID CC[C@H](NC(=O)c1ccccc1)c1c(C)noc1C 160623632 QKWJYONOXOXIHE-ZDUSSCGKSA-N 258.321 3.173 70 20 CGID Cc1cccc(C(=O)N[C@@H](C)CC(=O)c2cccs2)c1 160862185 XIVJVQXNWNSIFC-LBPRGKRZSA-N 287.384 3.448 70 20 CGID CC[C@H](CCO)NC(=O)CCCCCc1cccs1 159402192 PNUSWOCCHJAFPG-CYBMUJFWSA-N 283.437 3.128 70 20 CGID Cc1cc(NC(=O)CC2CCC(C)(C)CC2)c[nH]c1=O 159844351 SXUSSHOPEMWGOR-UHFFFAOYSA-N 276.380 3.228 70 20 CGID O=C(CNC(=O)[C@H](c1ccccc1)C1CC1)c1cccs1 159514748 CVLHFWWOERMTPB-MRXNPFEDSA-N 299.395 3.241 70 20 CGID Cc1cnccc1CCNC(=O)NCC1CCC(C)CC1 159926962 GAIZEJFANACVOZ-UHFFFAOYSA-N 289.423 3.058 70 20 CGID O=C(Oc1cccc(Cl)c1Cl)[C@@H]1CCCCO1 159557149 BCZSRGNRTWSYPR-JTQLQIEISA-N 275.131 3.468 70 20 CGID CC[C@H](Nc1ccc(OC2CCCC2)cc1)C(=O)OC 159506164 NIQXCRHELYUQOB-HNNXBMFYSA-N 277.364 3.372 70 20 CGID C[C@H](NC1CC(C)(C)NC(C)(C)C1)c1cncc(F)c1 159627339 WXNHQOLYQLRYFR-NSHDSACASA-N 279.403 3.181 70 20 CGID Cc1cccc(C)c1CN[C@H]1CCN2CCC[C@@H]2C1 160388065 HVVQQOCDGZYIGP-JKSUJKDBSA-N 258.409 3.020 70 20 CGID Cc1ccccc1CNC(=O)Nc1cc(Cl)ccn1 217313840 SSPBFWAKIOFFQD-UHFFFAOYSA-N 275.739 3.365 70 20 CGID C1=CC[C@@H](CN[C@H]2CCN(Cc3ccccc3)C2)CC1 218572862 VBGZPOZSATUDMU-AEFFLSMTSA-N 270.420 3.207 70 20 CGID CCOc1cc2c(cc1CN[C@@H]1CCSC1)O[C@H](C)C2 218606558 UQZHDFVWEFLYFG-BXUZGUMPSA-N 293.432 3.004 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)N[C@@H](C)CC(C)C 161297130 YUIFKIDNHGJXNA-QWRGUYRKSA-N 266.385 3.336 70 20 CGID COc1ccc2c(OCc3nccs3)ccnc2c1 161370878 HHMBKRSZZHLERA-UHFFFAOYSA-N 272.329 3.279 70 20 CGID CS[C@@H](C)CC(=O)N(C)c1cc(C)cc(C)c1 160580850 FDZBZGMGTHYCGW-LBPRGKRZSA-N 251.395 3.408 70 20 CGID CCC(CC)CNC(=O)Nc1ccn(CC(F)(F)F)n1 160708341 FTFIYKMNNDBWJE-UHFFFAOYSA-N 292.305 3.003 70 20 CGID Cc1cc(=O)n(C)cc1NC(=O)CC1CCC(C)(C)CC1 159869274 NLQIMFMUKFDRFH-UHFFFAOYSA-N 290.407 3.239 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)Cc1ccc(O)cc1Cl 159498516 DJXSCBZMUBNEDG-IINYFYTJSA-N 281.783 3.283 70 20 CGID COc1ccc(N(C)C(=O)CCOC(C)C)cc1Cl 159896209 QQAKEGGXDNMPQO-UHFFFAOYSA-N 285.771 3.127 70 20 CGID O=C(CCc1ccccc1)N[C@@H]1CCOC2(CCCC2)C1 159533430 SFQZGUDKYISPOK-MRXNPFEDSA-N 287.403 3.227 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc(-c2ccc(F)cc2)[nH]n1 159986962 GFUPMQPQMAEFKT-UHFFFAOYSA-N 299.349 3.136 70 20 CGID O=C(N[C@H]1CCCc2sccc21)c1cncc(F)c1 160270160 MNQMKGLTKMZRHW-LBPRGKRZSA-N 276.336 3.090 70 20 CGID CSC[C@@H](CCO)N[C@H](Cc1ccc(C)cc1)C1CC1 160437356 OZZNLYZFYZSTSM-IAGOWNOFSA-N 293.476 3.020 70 20 CGID CCc1cc(C)c(C(=O)N(C)c2ccc3c(c2)OCO3)o1 160488976 BFFNPFUVLUHIAL-UHFFFAOYSA-N 287.315 3.156 70 20 CGID C[C@@H](CC(=O)N(C)CC(F)(F)F)c1ccc(F)cc1F 160729896 UXSKWKTVOZEPHR-QMMMGPOBSA-N 295.251 3.479 70 20 CGID CS[C@H](C)CC(=O)NC[C@H](C)COCc1ccccc1 160903865 OIGOJJQPWSCSNQ-UONOGXRCSA-N 295.448 3.097 70 20 CGID Cc1nccc(CNC(=O)C[C@@H]2CCCCC2(C)C)n1 159818578 KAFWRSWQNILZKR-ZDUSSCGKSA-N 275.396 3.008 70 20 CGID C[C@@H](C(=O)NCc1nc2ccccc2[nH]1)c1ccsc1 159821612 FRMHWIAANBWXDM-SNVBAGLBSA-N 285.372 3.044 70 20 CGID CC(C)(NC(=O)[C@@H]1CCC[C@H](N)C1)c1cccc(Cl)c1 159646255 MOQFGARYTGGKLT-RISCZKNCSA-N 294.826 3.209 70 20 CGID COCc1ccccc1NC(=O)N[C@@H](C)CC(C)C 159873544 XTBMBJAIBQXNQX-LBPRGKRZSA-N 264.369 3.389 70 20 CGID CC(C)(C)CCC(=O)N[C@H]1CCOC2(CCCC2)C1 159888289 OTSDKTYBCNORIH-ZDUSSCGKSA-N 267.413 3.421 70 20 CGID CN(C)[C@H](CNCc1cc(F)cc(F)c1)c1ccccc1 159599488 YADZHQWMZISGHS-QGZVFWFLSA-N 290.357 3.357 70 20 CGID CCc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159599029 VRBGDFGOPRVHPM-BBWFWOEESA-N 271.404 3.296 70 20 CGID CC(C)Sc1ccccc1NC(=O)CN(C)C(C)C 160937737 SLJLSERVUDJKOS-UHFFFAOYSA-N 280.437 3.466 70 20 CGID CC1CCN(CCNc2cc(Cl)nc(C3CC3)n2)CC1 217972863 QMOREIIWILRHIE-UHFFFAOYSA-N 294.830 3.151 70 20 CGID C[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1c(F)cccc1F 218438064 GYCGUJHPUYOTQT-LALPHHSUSA-N 283.362 3.414 70 20 CGID CC[C@H](CC1CCCCC1)C(=O)N[C@@H]1CCC[C@H](N)C1 161035740 WYLWTXIQDDAYLY-OWCLPIDISA-N 280.456 3.369 70 20 CGID CCCCC[C@@H](C)NC(=O)c1cc(OC)c(O)c(OC)c1 161367529 PKJSOIGOLYZHIU-LLVKDONJSA-N 295.379 3.108 70 20 CGID O=C(c1cccc(F)c1F)N1CCOc2cccc(F)c21 161506958 AEHCSTYENMLXRT-UHFFFAOYSA-N 293.244 3.143 70 20 CGID O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccnc1Cl 160008759 ABOYQVABKSOQRO-RRFJBIMHSA-N 298.773 3.051 70 20 CGID CCCC[C@H](Sc1nncc2ccccc12)C(=O)OC 160236818 IVBYHYKQEJZUHN-ZDUSSCGKSA-N 290.388 3.454 70 20 CGID CCCC[C@@H](Sc1nncc2ccccc12)C(=O)OC 160236956 IVBYHYKQEJZUHN-CYBMUJFWSA-N 290.388 3.454 70 20 CGID CC[C@@H](C)C(=O)N(C)c1ccc(OC)c(Cl)c1 160254013 QEJXOGYJHKTSGR-SECBINFHSA-N 255.745 3.358 70 20 CGID CC[C@H](NC(=O)Cc1ccc(C)cc1)c1c(C)noc1C 160336197 IMCWWMNBXZMEDD-HNNXBMFYSA-N 286.375 3.410 70 20 CGID CCN(C)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 160500893 IAGQTTAYPZTOSD-GJZGRUSLSA-N 260.381 3.059 70 20 CGID Cc1cccc(CSCCCCS(C)(=O)=O)c1 160908155 AWXWHASRSIFSMD-UHFFFAOYSA-N 272.435 3.053 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H](C)c2cnccn2)C1 159404390 ICDDDQNFMNVTDQ-XQQFMLRXSA-N 265.426 3.192 70 20 CGID Cc1ccccc1CC(=O)N[C@@H]1CCOC2(CCCC2)C1 159917201 COXLCOFJFXLRBO-MRXNPFEDSA-N 287.403 3.146 70 20 CGID Cc1nccc(NC(=O)N(C)c2c(C)noc2C)c1Cl 159370960 UHZHBTREJRHOHI-UHFFFAOYSA-N 294.742 3.317 70 20 CGID CC[C@H](NC(=O)Nc1c(F)cccc1F)[C@@H]1CCCO1 159379802 MSZXMBNMIXTECK-RYUDHWBXSA-N 284.306 3.044 70 20 CGID CCc1cc(O)nc(CN(C)Cc2ccccc2Cl)n1 160526173 RTMCDGORCIGVKY-UHFFFAOYSA-N 291.782 3.030 70 20 CGID CC(C)N1CC[C@H](CNCc2cc(F)cc(Cl)c2)C1 160909965 BNDCJIHKFLOZPO-GFCCVEGCSA-N 284.806 3.299 70 20 CGID CCC(CC)CC(=O)Nc1ccc(OC)c(N)c1 161148755 CHSQKXWTPZOFOZ-UHFFFAOYSA-N 250.342 3.042 70 20 CGID FC(F)(F)c1ccccc1CN[C@H]1CCN2CCCC[C@@H]12 217643635 NVQLGXPKROHVPR-GJZGRUSLSA-N 298.352 3.422 70 20 CGID C[C@@H]1CN(CCOc2cc(Cl)ccc2Cl)CCO1 217512098 LMGXQLGGIBUSKC-SNVBAGLBSA-N 290.190 3.093 70 20 CGID CCc1ncnc(N[C@H](C)Cc2cccs2)c1F 217969035 MFYQFSGPEYNZAO-SECBINFHSA-N 265.357 3.283 70 20 CGID CCc1cccc(NC2CCC(NC(C)=O)CC2)c1 161081897 DIYMHGXIWHGUBR-UHFFFAOYSA-N 260.381 3.108 70 20 CGID Cc1c(NC(=O)NCCC(C)C)cnn1CCC(C)C 161412519 FGKZAMMUYCDRNH-UHFFFAOYSA-N 280.416 3.405 70 20 CGID CSc1ccc([C@@H](C)NC2CCN(C)CC2)cc1F 161456050 BQYFXAGRPURUCV-LLVKDONJSA-N 282.428 3.292 70 20 CGID CC(C)Oc1ccc(CN[C@H](C)c2cncs2)cn1 160054540 JMCPDTFFBKQSOU-LLVKDONJSA-N 277.393 3.176 70 20 CGID O=C(Cc1cccc(Cl)c1)NCC1(C2CC2)CC1 160077239 IFXUUYUXVCJCOV-UHFFFAOYSA-N 263.768 3.189 70 20 CGID CCN1CC[C@@H](CNC(=O)C[C@@H]2CCCCC2(C)C)C1 160122087 KBEJGPVNLDSCJW-GJZGRUSLSA-N 280.456 3.051 70 20 CGID Cc1noc(C)c1CCSCCOC(C)(C)C 160136092 GHGFTOHLVADJOZ-UHFFFAOYSA-N 257.399 3.382 70 20 CGID Cc1ccc(C(=O)CCN2CCOC3(CCCC3)C2)cc1 160286162 YBMVANKDOWITJQ-UHFFFAOYSA-N 287.403 3.213 70 20 CGID C[C@H](CC(=O)NCc1ccn(C)c1)c1ccc(F)cc1F 160424441 WJJMFJMGHUIHRM-LLVKDONJSA-N 292.329 3.113 70 20 CGID COc1ccncc1NC(=O)c1ccc(F)c(SC)c1 160452350 LWEYXGWWNMGYQT-UHFFFAOYSA-N 292.335 3.204 70 20 CGID COc1ccc2cc(CNC(=O)[C@H]3CCCCO3)ccc2c1 160470233 ODZGAIGKAHNREY-QGZVFWFLSA-N 299.370 3.034 70 20 CGID Cc1cccc2c(CC(=O)N(C)Cc3cccn3C)c[nH]c12 160655970 CMPVKGBLEZUQIA-UHFFFAOYSA-N 295.386 3.016 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CCCCOC 160829271 GTWHXZUFBLVGPN-ZIAGYGMSSA-N 255.402 3.230 70 20 CGID CCNc1nc(C(=O)N2CCC[C@H](CC(C)C)C2)cs1 160925899 AQJMQWPOYZCAIE-GFCCVEGCSA-N 295.452 3.473 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@@H](C)c1ccc2ccccc2c1 160935232 CODPHMXGVYUMOC-KSSFIOAISA-N 299.414 3.467 70 20 CGID Cc1cccc([C@H](NC(=O)[C@H]2C[C@@H]2C)c2ccccn2)c1 159900861 AGZCEYBENJKCEG-QRTARXTBSA-N 280.371 3.252 70 20 CGID C[C@H](NC(=O)Nc1ccc(F)c(F)c1F)C1CCC1 159362473 ONTFSPALAJSSEM-ZETCQYMHSA-N 272.270 3.414 70 20 CGID C[C@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCCn1cccc1 159574845 RQQASCWVBDJLIY-XHSDSOJGSA-N 274.408 3.448 70 20 CGID CCc1nc(CN[C@@H](C)c2c(F)cccc2Cl)n[nH]1 160507291 QGPPZHFURSBDGO-QMMMGPOBSA-N 282.750 3.010 70 20 CGID Cc1cccc([C@@H]2CCCN2CCN2CCCCC2)n1 159780680 ZXEFXRXHBXVUKJ-KRWDZBQOSA-N 273.424 3.013 70 20 CGID CCCCn1nccc1NC(=O)CC(O)(CCC)CCC 161090737 PNOIBTWDBIYZID-UHFFFAOYSA-N 295.427 3.343 70 20 CGID Fc1ccc2c(c1)CCN(Cc1nc3ccccc3[nH]1)C2 161250160 MMIFOBIZVAWHHF-UHFFFAOYSA-N 281.334 3.260 70 20 CGID Cc1c(NC(=O)N2CC[C@H](C)[C@@H]2C)cnn1CCC(C)C 161315427 QTSRJMGNLIRLDQ-STQMWFEESA-N 292.427 3.500 70 20 CGID CC[C@@H]1CCCC[C@H]1NC[C@H](O)Cc1ccccc1 161422831 FKYCYLXXFQTKTI-BRWVUGGUSA-N 261.409 3.148 70 20 CGID Cc1ccccc1C(=O)N1CCOc2cccc(F)c21 161503468 WUDCXKFUMMAGOX-UHFFFAOYSA-N 271.291 3.173 70 20 CGID COCCCC(=O)O[C@@H](C)c1cc(C)ccc1OC 160125286 RVXPCSOOQWJGBM-LBPRGKRZSA-N 266.337 3.034 70 20 CGID C[C@H](NC(=O)[C@H]1CCCCO1)c1ccc2c(c1)CCCC2 160160809 GXYJTTVPLRQIRH-SUMWQHHRSA-N 287.403 3.312 70 20 CGID C[C@H]1CC[C@H](CC(=O)N(C)c2ccc3c(c2)OCO3)C1 160226747 UCWUWTYAQRLJRH-RYUDHWBXSA-N 275.348 3.204 70 20 CGID O=C(NCCC1=CCCC1)c1cccc(-n2ccnc2)c1 160233386 USTGQSMHLXWSHD-UHFFFAOYSA-N 281.359 3.103 70 20 CGID CCCC1(CNC(=O)c2c(F)cc(F)cc2F)CC1 160439907 YQYVOKSJZQNWCT-UHFFFAOYSA-N 271.282 3.414 70 20 CGID CCC[C@H](NCC(=O)NCC(F)(F)F)C1CCCCC1 160581810 BTPVGIKLYFWDQG-LBPRGKRZSA-N 294.361 3.004 70 20 CGID C[C@H](NC[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1N(C)C 160599199 YUHCRGJAHCLAIT-AHIWAGSCSA-N 294.414 3.093 70 20 CGID COc1ccc(C[C@H](C)C(=O)NC[C@H]2CC=CCC2)cc1 160707502 BLIOLLROSIOSCJ-HOCLYGCPSA-N 287.403 3.346 70 20 CGID C[C@H]1CCCN(C(=O)[C@@H](C)c2c(F)cccc2F)C1 160965419 PYLXUEJMFSRIGR-QWRGUYRKSA-N 267.319 3.327 70 20 CGID CC[C@H](NC(=O)Nc1cc(C)cc(C)c1)[C@H]1CCCO1 159398742 QUDNZIVYFUFTDS-LSDHHAIUSA-N 276.380 3.383 70 20 CGID C[C@H]1CCC[C@@H](C(=O)Nc2ccc3c[nH]nc3c2)C1 159766789 IFTITLFRGPYCLQ-WDEREUQCSA-N 257.337 3.328 70 20 CGID O=C(COc1ccc(Cl)c(F)c1)c1ccc[nH]1 161134534 KEGXFHVLKOMUIR-UHFFFAOYSA-N 253.660 3.069 70 20 CGID CC[C@H](NC(=O)Cc1cccs1)c1c(C)noc1C 160117827 OPEFDUBIPUYAQV-LBPRGKRZSA-N 278.377 3.163 70 20 CGID Cc1ccc(-c2nnc(NC(=O)C[C@H]3CC[C@@H](C)C3)[nH]2)o1 160188330 IAKMATABNZKXMP-KOLCDFICSA-N 288.351 3.138 70 20 CGID Cc1ccc(-c2nnc(NC(=O)[C@@H]3CCC[C@@H](C)C3)[nH]2)o1 160259135 IIVOVBDLPULBPL-MWLCHTKSSA-N 288.351 3.138 70 20 CGID CC(=O)c1c(F)cccc1N[C@@H]1CCO[C@@H](C2CC2)C1 160413111 BWZAGASVOJMCNS-IUODEOHRSA-N 277.339 3.398 70 20 CGID C[C@H](CC(=O)N[C@@H]1CCCc2occc21)c1ccncc1 160531475 GPTVZYXKXAYRSD-IUODEOHRSA-N 284.359 3.362 70 20 CGID CCCC1(CNC(=O)CSc2ccc(O)cc2)CC1 160592577 IQCVLBLNERXNNB-UHFFFAOYSA-N 279.405 3.181 70 20 CGID O=C(Cc1csc2ccc(Cl)cc12)NCC(F)F 159421597 ZYXBTNLHIFXNLM-UHFFFAOYSA-N 289.734 3.479 70 20 CGID CC(C)(NC(=O)[C@@H]1CCC[C@@H](N)C1)c1cccc(Cl)c1 159646556 MOQFGARYTGGKLT-BXUZGUMPSA-N 294.826 3.209 70 20 CGID O=C(Oc1cccc(C(F)(F)F)c1)[C@H]1CCCCO1 159465688 BPDDREWULMFVCS-LLVKDONJSA-N 274.238 3.180 70 20 CGID Cc1cc(C(=O)N2C[C@H](C)CSc3ccccc32)no1 159485234 SMDOKRNLPVPEHX-JTQLQIEISA-N 288.372 3.372 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(F)cc1C)[C@H]1CCCO1 159542100 JEZQQAIUVIMQPJ-TZMCWYRMSA-N 280.343 3.213 70 20 CGID NC(=O)[C@H](N[C@@H]1CCCc2cc(F)ccc21)c1ccccc1 159546808 ZIQLTHIQGKSDSV-IAGOWNOFSA-N 298.361 3.019 70 20 CGID CCCOC(=O)c1ccc(NCc2ccnn2CC)cc1 159998839 VXRAWUXMFZIPOH-UHFFFAOYSA-N 287.363 3.082 70 20 CGID CN(Cc1csc(C2CCCC2)n1)C[C@@H]1CCC[C@@H]1O 159695832 CYFYVARMUUHJIW-ZFWWWQNUSA-N 294.464 3.394 70 20 CGID Cc1cccc(CCNC(=O)NCC2CCCC2)c1 217578073 NQXSCFDQGOVQBQ-UHFFFAOYSA-N 260.381 3.027 70 20 CGID C[C@@H](C12CC3CC(CC(C3)C1)C2)S(=O)(=O)Cl 88251658 NUVCNDPXAPRPJY-JKJWBTBISA-N 262.802 3.160 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)N(C)CCC1CC1 161025917 WNXQVWQYPKWWMG-JTQLQIEISA-N 264.369 3.044 70 20 CGID COCCC1(CNC(=O)N2C[C@H](C)c3ccccc32)CC1 161062366 ZKSRTSHLTWZSTL-ZDUSSCGKSA-N 288.391 3.136 70 20 CGID CCc1ccc(CCC(=O)Nc2ccc(OC)c(N)c2)cc1 161161279 KPDKILVIZWYGPA-UHFFFAOYSA-N 298.386 3.411 70 20 CGID CCC[C@@H](CC)NC(=O)c1cnn(CC(C)C)c1C 161488580 WDOBGRIEWZKELO-CYBMUJFWSA-N 265.401 3.156 70 20 CGID O=C(C[C@@H]1CSCCS1)N1CCC[C@@H]1C1CCCC1 160251722 YHOQRAYEWUOFQF-ZIAGYGMSSA-N 299.505 3.406 70 20 CGID COCCC1(CNC(=O)NCC2(C3CC3)CCC2)CCC1 160387743 HGDUKPOMZKLXHW-UHFFFAOYSA-N 294.439 3.073 70 20 CGID CCc1ccc(C(C)(C)C(=O)N[C@H](CO)CC(C)C)cc1 160759559 WKXQFSHQRZGCGA-INIZCTEOSA-N 291.435 3.050 70 20 CGID CS[C@@H](C)CC(=O)N(C)c1ccc(F)c(F)c1 160920827 VTHUNMSSJKCYJO-QMMMGPOBSA-N 259.321 3.069 70 20 CGID COc1ccnc(NC(=O)[C@H](c2ccccc2)C2CC2)c1 159486895 NQDCMWZWOSKQOB-MRXNPFEDSA-N 282.343 3.223 70 20 CGID Cc1ccc(C(=O)N(C)C2CCC2)c(Br)c1 159938068 MQURFKCQZVPBGH-UHFFFAOYSA-N 282.181 3.382 70 20 CGID CC(C)Cn1cc(Nc2nc(C(C)(C)C)ns2)cn1 159741415 ZVCYBVKMFMZJIO-UHFFFAOYSA-N 279.413 3.432 70 20 CGID O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1ccc(F)c(F)c1 159955707 YCKKNGGGRYQKKH-JJRVBVJISA-N 299.320 3.281 70 20 CGID COc1cccc(Cl)c1CN[C@@H]1CCOC(C)(C)C1 159778556 GNPQELNBHNZHDZ-LLVKDONJSA-N 283.799 3.396 70 20 CGID CCC(CC)[C@H](O)CNCc1cccc2c1OC(C)(C)C2 217804355 WPAFGOFSVSNEIP-MRXNPFEDSA-N 291.435 3.287 70 20 CGID COCCCCCN(C)Cc1cccc(N(C)C)c1 159870371 YXCMOCDZYYBKKA-UHFFFAOYSA-N 264.413 3.001 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1ccc(Br)cn1 161456299 YEEFUOCJGWZVOU-JTQLQIEISA-N 287.201 3.053 70 20 CGID C[C@@H](NCc1cccc2cc[nH]c12)c1cccnc1 218075060 VOFPRPURJAZXOW-GFCCVEGCSA-N 251.333 3.414 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cccnc1Cl 161047643 ZCNHJGPIAFKNQF-XQQFMLRXSA-N 281.831 3.258 70 20 CGID Cc1cc2cc(NC(=O)NC3CC=CC3)ccc2[nH]1 160087474 KAZZAEYZBOONKS-UHFFFAOYSA-N 255.321 3.316 70 20 CGID CCN(CC(C)(C)O)C(=O)C[C@@H]1CCCCC1(C)C 160107148 DCQMXUKOWOKQLU-ZDUSSCGKSA-N 269.429 3.212 70 20 CGID O=C(NCCSc1ccc(Cl)cc1)[C@@H]1CCCCO1 160166631 UZRPIDUQEBIESB-ZDUSSCGKSA-N 299.823 3.117 70 20 CGID Cc1cc(O)c(C(C)C)cc1NC(=O)[C@@H]1CCCCO1 160262504 FKGPQNNLQCFESL-HNNXBMFYSA-N 277.364 3.332 70 20 CGID CCC[C@H](N[C@@H]1CCc2nc(C)nn2C1)c1ccccc1 160296624 VXVWKTKZBDFZRU-CVEARBPZSA-N 284.407 3.032 70 20 CGID CSC[C@@H](CCO)N[C@H](CCc1ccccc1)C(C)C 160350911 AORYMRAEGVOEQO-IAGOWNOFSA-N 295.492 3.347 70 20 CGID c1ccc(C[C@@H]2CCN(Cc3cnc4ccccn34)C2)cc1 160594303 AAWGCCBWKQVZHT-KRWDZBQOSA-N 291.398 3.399 70 20 CGID C[C@H](CNC(C1CC1)C1CC1)N1CCc2ccccc2C1 159800174 CUBDRCAVJPXJGS-CQSZACIVSA-N 284.447 3.211 70 20 CGID COc1cccc([C@H](C)C(=O)NCC2(C3CC3)CC2)c1 159800391 FQSMERWYSBHYBN-LBPRGKRZSA-N 273.376 3.105 70 20 CGID O=C(CCC1CCOCC1)N[C@H]1CCCc2sccc21 159849945 FCSMTDRCNKCZHQ-AWEZNQCLSA-N 293.432 3.449 70 20 CGID CCC[C@H](C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159537924 XQMLKWAZWCSFCE-STQMWFEESA-N 253.386 3.031 70 20 CGID CCCOc1ccc(CNCC2(CO)CCCC2)cc1 160109624 GRIHZHIDGKAQLN-UHFFFAOYSA-N 277.408 3.118 70 20 CGID CC(C)[C@@H]1CCCCN1CCCN1CCCCC1 161151716 NGDHCWVXGLAFLH-INIZCTEOSA-N 252.446 3.373 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1nc(C)ncc1Cl 161076679 KGTSALAFUASCTM-YPMHNXCESA-N 295.814 3.479 70 20 CGID Cc1ccc(NC(=O)NCC2(c3cccc(F)c3)CC2)cn1 161449576 KHKVDCZMZDWLBX-UHFFFAOYSA-N 299.349 3.382 70 20 CGID O=C(O[C@H](c1ccccn1)C(F)(F)F)C1CC=CC1 160115174 UTYKWZCSHAVRGK-LLVKDONJSA-N 271.238 3.194 70 20 CGID CS[C@@H](C)CNC(=O)N[C@@H]1CCCCC1(C)C 160265819 WHQIYHBMJHOBFC-WDEREUQCSA-N 258.431 3.006 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)C1[C@H]2CCC[C@H]12 160644961 KBCGHKIQNKZAIB-RDBSUJKOSA-N 277.408 3.031 70 20 CGID CC(C)CSCCCNC(=O)c1cc(C(C)C)n(C)n1 160754905 DDUHCWNZSSORRY-UHFFFAOYSA-N 297.468 3.053 70 20 CGID CC(C)C[C@@H](C)NC(=O)NCCc1cc2ccccc2[nH]1 160805380 DSXZZDGFXJWLFW-CYBMUJFWSA-N 287.407 3.444 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)Cc1ccc(F)c(F)c1 160936601 GAOCNELRDZJVJU-IAQYHMDHSA-N 267.319 3.359 70 20 CGID CSc1nsc(NC(=O)c2cc(C)cc(Cl)c2)n1 159604648 NUAIBJCESYPNRE-UHFFFAOYSA-N 299.808 3.474 70 20 CGID CC[C@H](c1ccccc1)N(CCOC(C)C)CC(=O)OC 159677884 VPQXPHTYUDBQHS-MRXNPFEDSA-N 293.407 3.038 70 20 CGID Cc1nsc(NC(=O)c2cc(F)c(Cl)cc2F)n1 159555524 WZIXBNWQVUBWQG-UHFFFAOYSA-N 289.694 3.030 70 20 CGID COc1ccc(Cl)cc1CC(=O)NCC1(C2CC2)CC1 159990463 QRIFNTMDZIDWQV-UHFFFAOYSA-N 293.794 3.198 70 20 CGID CC(=O)NC1CCC(Nc2ccccc2OC(C)C)CC1 161102443 KSARULNEBCUXQM-UHFFFAOYSA-N 290.407 3.333 70 20 CGID C[C@H](NCCc1ccc2c(c1)OCO2)c1cccs1 161125341 VHNUHZJNVAVXKT-NSHDSACASA-N 275.373 3.370 70 20 CGID Cc1nnc(CN2c3ccccc3S[C@@H](C)[C@@H]2C)o1 161146532 MQJRRLYTOLXUNT-UWVGGRQHSA-N 275.377 3.267 70 20 CGID CC(C)OCCN[C@H](c1ccc2c(c1)OCCO2)C(C)C 161478404 BORYXIDJVWDZLB-KRWDZBQOSA-N 293.407 3.170 70 20 CGID C[C@H](Cc1ccco1)Nc1nnc(C(F)(F)F)s1 160156336 PDFPBRSXKVKINF-ZCFIWIBFSA-N 277.271 3.193 70 20 CGID CCc1nsc(NC[C@](C)(O)c2ccccc2Cl)n1 160202169 YTOIQHBLYKIART-ZDUSSCGKSA-N 297.811 3.074 70 20 CGID CCC[C@@H](C)CC(=O)Nc1nnc(-c2ccc(C)o2)[nH]1 160389451 BXFJTSLWQZZBER-SECBINFHSA-N 276.340 3.138 70 20 CGID Cc1ccc(NC(=O)[C@@H]2CCCCO2)c2cccnc12 160706076 ACUUDRHISCWPQB-AWEZNQCLSA-N 270.332 3.051 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@@H](C)Cc1ccc(Cl)cc1 160798484 BHCCUNCIYDEWAI-SWLSCSKDSA-N 297.826 3.042 70 20 CGID COC[C@@H]1CCCN1C(=O)C[C@@H]1CCCCC1(C)C 160883713 YLYGIJJFWYQAOZ-KBPBESRZSA-N 267.413 3.230 70 20 CGID CC1(C)CCCC[C@H]1CC(=O)N1CCOc2ncccc21 160928338 CJGGJBMRMHDQCJ-ZDUSSCGKSA-N 288.391 3.414 70 20 CGID O=C(NCc1cccc2ccccc12)[C@H]1CCCCO1 160984355 CJJVFNUZDJNPAD-MRXNPFEDSA-N 269.344 3.025 70 20 CGID C[C@@H](C[C@H]1CCCO1)NC(=O)C1CCC(C)(C)CC1 159803362 LVBNUZQVNIIYPU-GXTWGEPZSA-N 267.413 3.277 70 20 CGID COc1c(F)cc(NC(=O)N2CC[C@@H](C)[C@@H](C)C2)cc1F 159737367 WKYCILBBGUKOAH-ZJUUUORDSA-N 298.333 3.483 70 20 CGID CC(C)Sc1ccccc1NC(=O)C[C@H]1COC(=O)C1 159565994 DEUBDPTZYUNCIX-LLVKDONJSA-N 293.388 3.079 70 20 CGID C[C@@H]1CN(C(=O)Nc2nnc(C(C)(C)C)s2)CC[C@H]1C 159763284 SBTRVNHOPVIIPM-NXEZZACHSA-N 296.440 3.345 70 20 CGID CCSCC[C@H](C)NC[C@H](O)c1c(F)cccc1F 160086285 LPZMHZFVSOGJOB-GWCFXTLKSA-N 289.391 3.120 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCN3CCCC[C@@H]23)c(F)c1 218125178 QUQUPNJLLZSQBG-ZLIFDBKOSA-N 292.398 3.112 70 20 CGID CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(C)nc2)C1 161332085 SVOMEQMIQTYCGW-AAEUAGOBSA-N 279.409 3.186 70 20 CGID CC(C)C[C@@H](C)NC(=O)c1csc([C@@H]2CCCO2)n1 161353217 ZILDEYNVVHXQLN-PWSUYJOCSA-N 282.409 3.159 70 20 CGID CCC[C@@H](C(=O)N[C@@H](C)CC(=O)OCC)c1ccccc1 160239443 HWSPMOAGIIIGNL-DZGCQCFKSA-N 291.391 3.028 70 20 CGID O=C(/C=C/c1cccnc1)N[C@@H]1CCCc2sccc21 160457046 HNJZODGRLQVLCB-PSKZRQQASA-N 284.384 3.350 70 20 CGID CN(C(=O)c1ccc2c(c1)CCC2)c1ccc2c(c1)OCO2 160555026 ORJJOKPLLJSVSO-UHFFFAOYSA-N 295.338 3.181 70 20 CGID Cc1n[nH]c(C)c1CN(C)Cc1ccc(OC(F)F)cc1 160632648 FDBNTSGIBGLKDD-UHFFFAOYSA-N 295.333 3.260 70 20 CGID Cc1cc(F)cc(NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c1 160662128 OIFOZPZOSVWOFM-IINYFYTJSA-N 263.312 3.078 70 20 CGID CC(C)COCCN[C@@H](Cc1ccccc1)C1CC1 160664017 ONWLISJZBZULCR-KRWDZBQOSA-N 261.409 3.270 70 20 CGID Cc1conc1NC(=O)[C@H](C)Cc1cccc(Cl)c1 160781188 GCABHNKCOASOOH-SECBINFHSA-N 278.739 3.454 70 20 CGID C[C@H]1CC(=O)CC[C@H]1c1nc(-c2ccc(F)c(F)c2)no1 160997247 JYCMEZLOVRPXLN-GZMMTYOYSA-N 292.285 3.488 70 20 CGID C[C@H]1CCC[C@@H](C)CN1C(=O)CCCn1cccc1 159676106 SSLVRXZBYDCAJK-CABCVRRESA-N 262.397 3.305 70 20 CGID CCC(CC)CNC(=O)N1CCc2ccccc2CC1 160541865 IKXZWCIPSQCPJY-UHFFFAOYSA-N 274.408 3.233 70 20 CGID CCN(Cc1ccccc1)C(=O)NCC1CCCC1 217569186 DFXWOHSWWNKGRZ-UHFFFAOYSA-N 260.381 3.408 70 20 CGID CC(C)C(=O)NCCCN[C@@H](C)c1cccc(Cl)c1 159971688 HSRYURWWLOYMND-LBPRGKRZSA-N 282.815 3.153 70 20 CGID C[C@@H]1CCC[C@@H](NC(=O)c2ccnc(Cl)c2F)C1 161412862 DGMUWDMKRPYYHD-RKDXNWHRSA-N 270.735 3.183 70 20 CGID CCCC[C@@H](COC)NC1CC(C)(C)NC(C)(C)C1 159621342 PTQYADCDIDAZPE-ZDUSSCGKSA-N 270.461 3.090 70 20 CGID C[C@@H](CCc1ccc(OC(F)F)cc1)S(=O)(=O)Cl 310333795 MYKZJPQLRMDTGO-QMMMGPOBSA-N 298.738 3.178 70 20 CGID CC[C@H](N)C(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 161235716 YSVBYXLBMKNCOI-CWRNSKLLSA-N 274.408 3.032 70 20 CGID Cc1cc(C[C@@H](C)NC(=O)CCC2CCCCC2)n[nH]1 161330096 AVORPNFGPAKFDJ-GFCCVEGCSA-N 277.412 3.126 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@@H]1c1ccc(F)cc1 160200448 DUVBFMGHQDJVSU-HUUCEWRRSA-N 273.351 3.236 70 20 CGID FC(F)(F)c1cccc(N[C@@H]2CCO[C@H](C3CC3)C2)n1 160297329 SZFKUITZZAKGJW-MNOVXSKESA-N 286.297 3.470 70 20 CGID CC[C@H](CN[C@H](C)C1CCOCC1)Oc1ccccc1F 160341484 MKOUXRHNUAAZLC-UKRRQHHQSA-N 295.398 3.388 70 20 CGID CCN(C(=O)N[C@H]1CCO[C@H](C2CC2)C1)C1CCCCC1 160427998 LHNKRBQOHGUICH-HOCLYGCPSA-N 294.439 3.308 70 20 CGID CC[C@@H](C)Oc1cc(C(=O)Nc2cccc(F)n2)ccn1 160574700 YECWFCRJVRKZSE-SNVBAGLBSA-N 289.310 3.045 70 20 CGID COc1ccc(C[C@@H](C)C(=O)NC[C@H]2CC=CCC2)cc1 160707623 BLIOLLROSIOSCJ-ZBFHGGJFSA-N 287.403 3.346 70 20 CGID CC(C)[C@H](Cc1ccccc1)C(=O)N(C)Cc1cccn1C 160823346 VQFKSUHREOECJM-SFHVURJKSA-N 298.430 3.498 70 20 CGID CN(Cc1ccco1)C(=O)c1cc(F)c(Cl)cc1F 160833975 HELLJMQNXSBEIY-UHFFFAOYSA-N 285.677 3.483 70 20 CGID CC(C)C[C@H](N)C(=O)N[C@H](C)c1ccc(F)cc1Cl 159624889 SLORBJDVEBLQOO-RNCFNFMXSA-N 286.778 3.030 70 20 CGID c1ccc(C[C@H](N[C@@H]2CCCSC2)C2CC2)cc1 159529263 VHGHKTWWTCYACN-CVEARBPZSA-N 261.434 3.493 70 20 CGID CCC(=O)Nc1ccc(N[C@H](C)CCn2cccn2)cc1 159377012 XRDZOPDXUZONOC-CYBMUJFWSA-N 286.379 3.122 70 20 CGID Cc1ccc(CNC(=O)NCCc2ccncc2C)c(C)c1 159594501 MNQKZKQLAWQRGQ-UHFFFAOYSA-N 297.402 3.049 70 20 CGID COc1ccc(NC(=O)[C@H]2CCC[C@@H](C)C2)cc1N 161255420 HPYKDDFBCOYBPP-MNOVXSKESA-N 262.353 3.042 70 20 CGID CN(C)[C@@H]1CCC[C@H](N[C@@H]2CCc3ccccc32)C1 161034513 BOXOVJHDLKZTBA-ZMSDIMECSA-N 258.409 3.136 70 20 CGID CC(C)Cc1ccc(CNC[C@H](C)N(C)C2CC2)cc1 217578863 ANLYKVWEUABGCQ-HNNXBMFYSA-N 274.452 3.457 70 20 CGID O[C@@H]1CCC[C@H]1[C@@H]1CCCN1Cc1cc(F)cc(F)c1 218730980 MLBGQFXLJJAMIE-HRCADAONSA-N 281.346 3.090 70 20 CGID COCCC1(CNC(=O)N2CCCC[C@@H]2CC(C)C)CC1 161033188 WESSOMSCWGAFND-OAHLLOKOSA-N 296.455 3.413 70 20 CGID Cc1noc(C)c1N(C)C(=O)Nc1cc(F)c(F)c(F)c1 161210808 LPKNNIHHZSTCAT-UHFFFAOYSA-N 299.252 3.377 70 20 CGID Cc1cc(Cl)ccc1OCC(=O)N1[C@@H](C)CC[C@H]1C 161402014 GHAQFNLUEOUNJO-TXEJJXNPSA-N 281.783 3.427 70 20 CGID CC(C)CN1CCC[C@@H]1CNC(=O)c1ccc2[nH]ccc2c1 160422331 IEDWPNDTUWYAAH-MRXNPFEDSA-N 299.418 3.018 70 20 CGID Cc1ccnc(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160533907 FGRKPZDXVAJXHK-GJZGRUSLSA-N 269.348 3.117 70 20 CGID CCC[C@@H](CCc1ccccc1)NC(=O)C[C@@H]1CCCN1 160938582 IDAMUDZHLPROPH-IRXDYDNUSA-N 288.435 3.046 70 20 CGID O=C(COc1ccc(Cc2ccccc2)cc1)N1CCCC1 159429923 TXJYGWSYWMGVFI-UHFFFAOYSA-N 295.382 3.279 70 20 CGID COc1cccc(CCCN(C)Cc2cscn2)c1 159642194 ICYJCGXFHYMPHH-UHFFFAOYSA-N 276.405 3.216 70 20 CGID Cc1cc(Cl)ccc1C(=O)N(C)CC(=O)OC(C)(C)C 159517867 FGRUQBHIOYRFHJ-UHFFFAOYSA-N 297.782 3.062 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cccc(F)c1F 159941417 KHUCJGDOLFCICV-LLVKDONJSA-N 295.329 3.186 70 20 CGID Cc1cccc(C)c1CN[C@@H]1CCCc2c1cnn2C 160419354 YQDMKVREZFGSDJ-MRXNPFEDSA-N 269.392 3.204 70 20 CGID CCCCOCCCNC(=O)NCCc1ccccc1C 217315621 IWPWBUHSVSBIOJ-UHFFFAOYSA-N 292.423 3.044 70 20 CGID Cc1cc(C)cc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1 161010556 IDLRQBPKGWRZHC-GOEBONIOSA-N 288.391 3.383 70 20 CGID CCCCOc1cccc(NC(=O)[C@@H](CC)N(C)C)c1 161067418 JZWOGLKDBOQQRX-OAHLLOKOSA-N 278.396 3.144 70 20 CGID Cc1cccc(C)c1CS[C@@H](C)C(=O)N(C)C 161387593 XYGYITRMWLSIPX-LBPRGKRZSA-N 251.395 3.013 70 20 CGID Cc1ccc(NC(=O)N[C@H](C)CNc2ccccc2)cn1 161417897 LDCWQFMQNVEGLI-CYBMUJFWSA-N 284.363 3.012 70 20 CGID CC[C@H]1CCCC[C@@H]1NCC[S@@](=O)c1ccccc1 161424360 QRJUJLRELVUDKV-QOKNQOGYSA-N 279.449 3.353 70 20 CGID CC(C)[C@@H](C)CC(=O)N1CCO[C@@H](c2cccs2)C1 161466392 ZJXMVWZFYKAYOS-QWHCGFSZSA-N 281.421 3.330 70 20 CGID C[C@@H](Cc1ccccc1Cl)C(=O)N1CCO[C@H](C)[C@@H]1C 160042268 JEFPSOPHFUNKII-RWMBFGLXSA-N 295.810 3.154 70 20 CGID Cc1ccc(C(=O)CCN2CC[C@@H](OCC(C)C)C2)cc1 160170157 QCDOONUIRQFECK-QGZVFWFLSA-N 289.419 3.315 70 20 CGID CCC1(C(=O)NCCCSCC(C)C)CCC1 160704515 SSLWJIYQEYVDBP-UHFFFAOYSA-N 257.443 3.462 70 20 CGID CS[C@@H](C)CNC(=O)N[C@H]1CCCCC1(C)C 160266092 WHQIYHBMJHOBFC-QWRGUYRKSA-N 258.431 3.006 70 20 CGID CC[C@H]1CCCN(C(=O)c2cc([C@H](C)CC)no2)C1 160325148 RKTPDEPKQXXKMX-NEPJUHHUSA-N 264.369 3.450 70 20 CGID CSC[C@@H](CCO)N[C@@H](Cc1cccc(C)c1)C1CC1 160394102 VMADDRGWTZAAHE-SJORKVTESA-N 293.476 3.020 70 20 CGID CN(Cc1cccn1C)C(=O)CCc1ccccc1Cl 160514712 HUNXKAGHZNWROE-UHFFFAOYSA-N 290.794 3.270 70 20 CGID Cc1cccc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H](N)C2)c1C 160721019 ZKQASOMWHLUKJW-HLLBOEOZSA-N 286.419 3.094 70 20 CGID CC[C@@]1(C)CCCN(Cc2cnc3ccccn23)C1 160865141 AGSNQMDWIPYCMN-INIZCTEOSA-N 257.381 3.346 70 20 CGID N[C@H]1CCC[C@@H](NC(=O)CCc2ccc3ccccc3c2)C1 160855910 FRGOCIIGAZHECP-ZWKOTPCHSA-N 296.414 3.159 70 20 CGID CCSCC[C@H](C)N(C)Cc1cnc2ccccn12 160904419 NZHPZCRMJWZACM-ZDUSSCGKSA-N 277.437 3.298 70 20 CGID CCCCn1ncc(NC(=O)N[C@@H]2CCC[C@H]2C)c1C 159801256 SFHVANRKEOXCMM-DGCLKSJQSA-N 278.400 3.302 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCCOCC1CC1 159847499 PVKJPSIXCPUUFW-KBPBESRZSA-N 293.432 3.093 70 20 CGID Cc1cc(C)cc(CCN[C@H]2CCCc3c2cnn3C)c1 159514263 SZBJJXXUEARTRZ-KRWDZBQOSA-N 283.419 3.247 70 20 CGID O=C(CNC(=O)[C@@H](c1ccccc1)C1CC1)c1cccs1 159514613 CVLHFWWOERMTPB-INIZCTEOSA-N 299.395 3.241 70 20 CGID Cc1c(C(=O)N2CCCc3ccccc32)cnn1CC(C)C 159920753 XHFGLFDLDMSXQD-UHFFFAOYSA-N 297.402 3.441 70 20 CGID CCC(CC)(CN)C(=O)N[C@H](C)CCC(C)(C)C 161238123 IVGOITVVEZOXJD-GFCCVEGCSA-N 256.434 3.083 70 20 CGID COC(=O)Nc1cccc(NC(=O)N[C@H](C)CC(C)C)c1 161028629 LEFYYHFSAVNCMF-LLVKDONJSA-N 293.367 3.421 70 20 CGID CC(C)c1ccc(C(=O)N[C@@H](C)c2cccnc2)cn1 161057237 QTKUMZNILGFCSH-LBPRGKRZSA-N 269.348 3.091 70 20 CGID CC(=O)NC1CCC(Nc2ccc(-c3cnco3)cc2)CC1 161073725 MAXJSZBJQFWZQG-UHFFFAOYSA-N 299.374 3.201 70 20 CGID CN(Cc1cscn1)C(=O)C(C)(C)C1CCCC1 161129400 CVGYWXUEPNEXSY-UHFFFAOYSA-N 266.410 3.318 70 20 CGID CC1(O)CCN(CCOc2ccc3ccccc3c2)CC1 161232235 GYGIQJGMYVFYQP-UHFFFAOYSA-N 285.387 3.065 70 20 CGID CCCn1nccc1CNc1ccc(NC(C)=O)c(C)c1 160006032 JNYDVSIUPIHHJS-UHFFFAOYSA-N 286.379 3.172 70 20 CGID Cc1cc(C)nc(NC[C@@](C)(O)c2ccccc2Cl)n1 160167121 GOUUVDAZSPUGFF-OAHLLOKOSA-N 291.782 3.066 70 20 CGID CC(C)(C)c1ccccc1C(=O)NCC1(CO)CCCC1 160291215 GXJBVUCOUMVQBO-UHFFFAOYSA-N 289.419 3.267 70 20 CGID CCCN(CCN(C)C)C(=O)[C@@H](CC)c1ccc(F)cc1 160335610 CREUOXUYSGCJNT-INIZCTEOSA-N 294.414 3.120 70 20 CGID CCC[C@@H](C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160475932 DJQFEOOUMJQFCC-KGLIPLIRSA-N 267.413 3.421 70 20 CGID CC[C@H](NCC(C)(C)O)c1cc(Cl)ccc1OC 160598498 SEFWVFFLPZWYGP-LBPRGKRZSA-N 271.788 3.160 70 20 CGID C[C@H](NCC(C)(C)O)[C@@H](C)c1nc2ccccc2s1 160621284 WVLZAICZGAWCSA-MNOVXSKESA-N 278.421 3.149 70 20 CGID CC(C)c1ccc(C(=O)NOCc2cccnc2)cc1 160793661 NUIJATCYHXRYPX-UHFFFAOYSA-N 270.332 3.067 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](C)c2cnccn2)C1 159403977 ICDDDQNFMNVTDQ-RWMBFGLXSA-N 265.426 3.192 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2noc(C(C)C)n2)n1 159738259 ATLHIDLKCSPBOX-AWEZNQCLSA-N 286.379 3.234 70 20 CGID CCc1ccc(CC(=O)Nc2ccc3c[nH]nc3c2)cc1 159763166 VFKWDLKTFXMOHF-UHFFFAOYSA-N 279.343 3.307 70 20 CGID COc1ccc([C@H](C)NCC2(CO)CCCC2)c(F)c1 160074523 BACMMHKKYQECEW-LBPRGKRZSA-N 281.371 3.038 70 20 CGID Cc1cccc(C(=O)Nc2ccc3cn[nH]c3c2)c1F 161434100 HPHIGSHZLSKRST-UHFFFAOYSA-N 269.279 3.263 70 20 CGID COc1cccc(NC(=O)N2[C@H]3C=CC[C@H]2CC3)c1 218752675 WHMOTYDKGZKEGC-STQMWFEESA-N 258.321 3.020 70 20 CGID CSCCCN1CCC[C@H]1c1cccc(C)n1 159712507 FMQQSWGUVUWLRX-AWEZNQCLSA-N 250.411 3.280 70 20 CGID COc1c(Cl)cccc1NC(=O)NOCC(C)C 159521395 RVUHKRKWBDHXOD-UHFFFAOYSA-N 272.732 3.058 70 20 CGID CC[C@@H](CC1CCCC1)C(=O)N[C@@H](CO)CC(C)C 161080047 HLTRMHFTTNROQK-LSDHHAIUSA-N 269.429 3.116 70 20 CGID CC[C@@H]1CCCCN1C(=O)c1cc(OC)c(OC)cc1F 161121378 QWUCUXLEDHBTRE-LLVKDONJSA-N 295.354 3.248 70 20 CGID c1cc(-c2nc(C3CCCCC3)no2)cc(-n2ccnn2)c1 161452040 WKACUZDNPGEULB-UHFFFAOYSA-N 295.346 3.365 70 20 CGID CC[C@@H](N[C@@H](C)CCOC)c1ccc(F)cc1F 160859443 XUXOTXSIMCCAKD-IINYFYTJSA-N 257.324 3.431 70 20 CGID COc1ccccc1CN(C)C(=O)c1ccc(C(C)C)nc1 159824126 JNZODSILGQLZGF-UHFFFAOYSA-N 298.386 3.486 70 20 CGID CCOc1ccc(NC(=O)[C@@H]2C[C@@]2(C)CC)cc1OC 159842445 RIAWYXCQTWXBIY-BLLLJJGKSA-N 277.364 3.469 70 20 CGID CCC(CC)n1ncc(C(=O)Nc2c(C)n[nH]c2C)c1C 159922021 ZHGOFWPJFFMAFF-UHFFFAOYSA-N 289.383 3.145 70 20 CGID CC[C@H](NC(=O)Nc1ccnc(C)c1Cl)[C@H]1CCCO1 159942949 SASOHPKFPNMZON-CMPLNLGQSA-N 297.786 3.123 70 20 CGID C[C@@H]1CCC[C@H](NCc2ccc(N(C)C)nc2)[C@@H]1C 159556052 HJYOGWZBOSTKKP-NFAWXSAZSA-N 261.413 3.062 70 20 CGID CCCCc1nc(CN2CC[C@@H]3CCCC[C@@H]32)no1 159706207 AGIWFFOQCZHCMV-STQMWFEESA-N 263.385 3.177 70 20 CGID CCCN1CCC(NCc2coc3ccccc23)CC1 159800708 RRJJMTJZQUTZMR-UHFFFAOYSA-N 272.392 3.397 70 20 CGID Cc1nc2c(n1CC(=O)c1cc(F)ccc1F)CCCC2 216711433 CFPNYHDPXCJPPR-UHFFFAOYSA-N 290.313 3.231 70 20 CGID C[C@H](NC(=O)N1CCCCCC1)c1ccsc1 160525058 FHLQWGGIQBNWGF-NSHDSACASA-N 252.383 3.395 70 20 CGID C[C@@H](CNCc1cccc(C2CC2)c1)N(C)C1CC1 217534772 NADOCRHCZKJNIG-ZDUSSCGKSA-N 258.409 3.136 70 20 CGID O=C(CC[C@@H]1CCCCO1)N1CCc2c(F)cccc2C1 161098591 UNGRILGNRZFADL-AWEZNQCLSA-N 291.366 3.060 70 20 CGID CC(C)OCCCC(=O)N[C@@H]1CCCc2sccc21 160163552 LSHDEFFRNIHIAA-CYBMUJFWSA-N 281.421 3.447 70 20 CGID COc1ccc(N(C)C(=O)[C@H](C)SC)cc1Cl 160167107 FNESGHJKMJCOOK-QMMMGPOBSA-N 273.785 3.063 70 20 CGID O=C(N[C@@H]1CCO[C@H](C2CC2)C1)N(C1CCCC1)C1CC1 160347182 UQHVDKBIJJWXDA-CJNGLKHVSA-N 292.423 3.061 70 20 CGID CC1(C)C[C@@H](NC/C=C/c2ccc(F)cc2)CCO1 160461183 BKPLAQTXFKUVED-BWPKMQGJSA-N 263.356 3.386 70 20 CGID CC(C)C[C@H](CO)NC(=O)CC[C@@H](C)c1ccccc1 160709516 OXWSLMTYWCNLOV-GDBMZVCRSA-N 277.408 3.094 70 20 CGID C[C@H](c1ccc(Br)cc1)N(C)C[C@H](O)C1CC1 160871380 ULNLTVWUOWWRDO-YGRLFVJLSA-N 298.224 3.213 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)CC(F)F 159613498 GSSQTFPUFBICSD-UHFFFAOYSA-N 250.333 3.109 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)[C@@H]2CCCCO2)C1 159639837 YIOZERAKDKZZQL-OCCSQVGLSA-N 291.416 3.331 70 20 CGID CCCn1ccc2ccc(NC(=O)[C@@H]3CC[C@H](N)C3)cc21 159851287 SUDUIBRIYWTBPN-KGLIPLIRSA-N 285.391 3.117 70 20 CGID Cc1c(NC(=O)N[C@@H](C)C2CC2)cnn1CCC(C)C 159493291 BTAMTKMLECOICT-NSHDSACASA-N 278.400 3.158 70 20 CGID C[C@@H](NCCO)c1ccc(SC2CCCC2)cc1 159720484 KIVOSRXPXNZULG-GFCCVEGCSA-N 265.422 3.364 70 20 CGID CN(CCN(C#N)c1ccccc1)c1ccccc1 159368014 NOCRVUQLJBVTFX-UHFFFAOYSA-N 251.333 3.110 70 20 CGID COC(=O)[C@@H](Sc1ccncc1)c1ccccc1 159971257 ADECLOVDSQBIKY-ZDUSSCGKSA-N 259.330 3.088 70 20 CGID CN(Cc1c(F)cccc1Cl)C[C@@H]1CCC[C@@H]1O 159463638 QRRIQLAPEQGMII-HZMBPMFUSA-N 271.763 3.072 70 20 CGID CN(CCSc1ccccc1F)C[C@@H]1CCC[C@@H]1O 159840574 PDGVGYQRFLYYFA-JSGCOSHPSA-N 283.412 3.011 70 20 CGID CC(C)CO[C@@H]1C[C@H](N[C@@H]2CCOC(C)(C)C2)C1(C)C 159959640 MPFGEECIFPUPMK-QLFBSQMISA-N 283.456 3.373 70 20 CGID O[C@@H](CNCc1ccc(Cl)cc1F)c1ccccc1 160683160 OWDCYDHEWHUSFI-HNNXBMFYSA-N 279.742 3.302 70 20 CGID CN(Cc1ccccc1)C(=O)NCCc1cccc(F)c1 217439480 MDYFOOUEMTVZIJ-UHFFFAOYSA-N 286.350 3.210 70 20 CGID CCC(C)(C)OC[C@H](CS(=O)(=O)Cl)C(C)C 114476990 RJHWHPLSWUHQEZ-SNVBAGLBSA-N 270.822 3.032 70 20 CGID C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239106 XRUOWEKRZZEVGE-ZWNOBZJWSA-N 299.367 3.110 70 20 CGID COc1ccc(C(=O)NC[C@H]2CCC[C@@H](C)C2)c(F)c1 218013018 IVVYEKHNZMJJPU-NEPJUHHUSA-N 279.355 3.390 70 20 CGID COc1ccc([C@@H](C)N[C@H]2CCC[C@H](N(C)C)C2)c(F)c1 161016544 YQRBXJWLMRNFDO-RDBSUJKOSA-N 294.414 3.358 70 20 CGID COCC[C@@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C(C)C 161038239 BMYMPXSYWXMLRJ-CXAGYDPISA-N 293.407 3.170 70 20 CGID CCN(Cc1ccccn1)C(=O)C[C@@H](C)c1ccncc1 161395441 BJABVDNOHAQBFD-CQSZACIVSA-N 283.375 3.019 70 20 CGID C[C@H](NC[C@H](C1CCCCC1)N(C)C)c1ccco1 160415798 KDDYVOPJAXXMKB-DZGCQCFKSA-N 264.413 3.441 70 20 CGID CCc1ccc(CNC(=O)NC[C@@]2(C)CCCS2)s1 160686475 QCIGMXAIBDFMCL-CQSZACIVSA-N 298.477 3.395 70 20 CGID COCCC1(C(=O)NCCCOC2CCCCC2)CCC1 159503121 QSDBYVDAVQGBAE-UHFFFAOYSA-N 297.439 3.049 70 20 CGID CCOC(=O)C[C@@H](C)Sc1nc(C(C)(C)C)ns1 159516884 UFYUJVUAZARIDL-MRVPVSSYSA-N 288.438 3.269 70 20 CGID CN(C[C@@H]1CCC[C@@H]1O)[C@@H]1CCc2c(Cl)cccc21 159721902 JVGMTZLAZBZNBC-XZJROXQQSA-N 279.811 3.420 70 20 CGID CCC[C@H]1CN(C(=O)N[C@@H](C)c2ccc(C)cc2)CCO1 159952002 UYGMAGIXODDUMS-HOCLYGCPSA-N 290.407 3.267 70 20 CGID CCOC(C)(C)CNc1nc2ccccc2nc1C 159531866 DEBIXMPRPRTACY-UHFFFAOYSA-N 259.353 3.165 70 20 CGID CC(C)[C@@H](CCO)NC(=O)CCCC1CCCCC1 160556886 QGJSNBIGJGJZRQ-OAHLLOKOSA-N 269.429 3.260 70 20 CGID C[C@@H]1CCN(C(=O)c2ccnc(F)c2F)[C@@H]2CCCC[C@@H]12 218389368 VDZIRGYXOVFHBM-NTZNESFSSA-N 294.345 3.401 70 20 CGID Cc1ccsc1CCCc1nc([C@@H]2CCOC2)no1 161027051 KEPJQHJIMUDXQI-LLVKDONJSA-N 278.377 3.119 70 20 CGID CCC1(CNC(=O)NCCCSC)CCCC1 161041408 IPGPLIFRBTYSEJ-UHFFFAOYSA-N 258.431 3.009 70 20 CGID CCN(CC)C(=O)c1cccc(OCc2nccs2)c1 161371575 LUXWWSXLOWALMK-UHFFFAOYSA-N 290.388 3.204 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@H]2CCC(=O)C[C@@H]2C)c1 161459190 MFPHCQAZGMMCIF-NHYWBVRUSA-N 287.359 3.223 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)CCCCSC 160075642 HCWMTMWPDFRSNI-AWEZNQCLSA-N 293.432 3.332 70 20 CGID C[C@H]1CCN(C(=O)Nc2cccc(F)c2F)C[C@H]1C 160466368 NQNHYBNZDKTLHG-VHSXEESVSA-N 268.307 3.475 70 20 CGID Cc1[nH]ccc1C(=O)NCCc1csc(C(C)(C)C)n1 160685755 HJKUSIYFQRWMGW-UHFFFAOYSA-N 291.420 3.050 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc(C)nc1 160905717 FGAZBRIGQDIKNN-HZPDHXFCSA-N 274.408 3.360 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@@H]1c1ccc(F)cc1F 159869286 OAXMTHGDHAQNBQ-ZIAGYGMSSA-N 291.341 3.375 70 20 CGID Cc1cc(Br)oc1C(=O)NCC1(C2CC2)CC1 159893689 PDXYHFSPCFBJFB-UHFFFAOYSA-N 298.180 3.271 70 20 CGID CCC(=CC(=O)N[C@H]1CCOC2(CCCC2)C1)CC 159372207 JJTOVMDDWBKZRS-AWEZNQCLSA-N 265.397 3.341 70 20 CGID Cc1cc(C)cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159607589 PKMXEMGIWXPADF-BBWFWOEESA-N 271.404 3.351 70 20 CGID Cc1cccc([C@H](C)N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 160188077 BLCMZPHUZURCFN-XZDPQHSOSA-N 259.393 3.459 70 20 CGID C[C@H]1CCN(C(=O)CCc2ccc(F)cc2F)[C@@H]1C 160711293 NTRRHBSJMKJRML-WDEREUQCSA-N 267.319 3.154 70 20 CGID CC/C(C)=C(/C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 123058469 OXBLLRZCCDFFJJ-KTKRTIGZSA-N 285.340 3.030 70 20 CGID C/C(=C/c1ccccc1)CNCCN1CCC[C@@H](C)C1 216986772 NQAXULMPMZHTCQ-UDLNKVAWSA-N 272.436 3.411 70 20 CGID C[C@@H]1CCN(C(=O)Nc2cc(C(C)(C)C)on2)C[C@@H]1C 161084356 HGDLSDRFZSYQOF-MNOVXSKESA-N 279.384 3.482 70 20 CGID CN(C(=O)[C@]1(C)CCCNC1)c1ccc2ccccc2c1 161301902 OQXPFBREABUUKV-GOSISDBHSA-N 282.387 3.192 70 20 CGID Cc1cccc([C@H](O)CNc2nc(C(C)(C)C)ns2)c1 160011686 XKCXPHULVARHAJ-GFCCVEGCSA-N 291.420 3.290 70 20 CGID CCNC(=O)c1cccc(CNC2[C@H](C)CCC[C@H]2C)c1 160187462 VMESGOGNBOTQNQ-ZIAGYGMSSA-N 288.435 3.351 70 20 CGID CCCCO[C@@H]1C[C@@H](N[C@@H](C)C2CCOCC2)C1(C)C 159807572 JNNRRCRXVFXYGT-NUEKZKHPSA-N 283.456 3.375 70 20 CGID Cc1ccc(NC(=O)N(C)[C@H]2CCSC2)cc1F 159416968 UFGPMJXIFMMLBV-NSHDSACASA-N 268.357 3.103 70 20 CGID CCOc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159475366 SOWKZUNPBFZLQG-BBWFWOEESA-N 287.403 3.133 70 20 CGID CC[C@@H](NC(=O)Nc1c(C)cccc1C)[C@@H]1CCCO1 159485079 MAFGFIXTZUPROC-KGLIPLIRSA-N 276.380 3.383 70 20 CGID CCC1(CNC(=O)N2CCc3cccc(F)c3C2)CC1 159684347 JOLUOJLFRMSPKB-UHFFFAOYSA-N 276.355 3.084 70 20 CGID C[C@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCn1cccc1 159574583 RQQASCWVBDJLIY-JYJNAYRXSA-N 274.408 3.448 70 20 CGID CC1(C)C[C@H](NC[C@H]2CCOc3ccccc32)CCO1 159776661 BCXIPPBHZDONRE-ZIAGYGMSSA-N 275.392 3.100 70 20 CGID Cc1cccc([C@H](C)N[C@@H](C)c2cn(C)nc2C)c1 160182073 NDNQDPDLFYKMNH-STQMWFEESA-N 257.381 3.449 70 20 CGID CC1(O)CCN(C(=O)c2cc3ccc(F)cc3s2)CC1 161307407 IXLFKKGBPABMQP-UHFFFAOYSA-N 293.363 3.027 70 20 CGID CC[C@H](SC)c1nc(CC(=O)Nc2ccccc2)no1 161274706 DXCYIBZXVAGXDL-NSHDSACASA-N 291.376 3.065 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)NCc1nc2ccccc2s1 161406841 GJDVFDPTYNBXCE-GHMZBOCLSA-N 289.404 3.379 70 20 CGID CCSc1cc(C(=O)N2[C@@H](C)CC[C@@H]2C)ccn1 161483867 XUUFPENUTCAAAF-QWRGUYRKSA-N 264.394 3.207 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 160165129 QYRAHICTRDCAHN-YOEHRIQHSA-N 286.375 3.188 70 20 CGID CCOc1ccc(OC(=O)C2=C(C)OCCC2)cc1 160467780 WXJRAXOVZKPVRU-UHFFFAOYSA-N 262.305 3.075 70 20 CGID COc1ccccc1C(C)(C)NCCCOC(C)C 160552253 IGGRRHHCLVPPIQ-UHFFFAOYSA-N 265.397 3.335 70 20 CGID C[C@@]1(CNC(=O)N[C@@H]2CCCc3occc32)CCCS1 160672594 NQIHOBQOMLUPLD-DOMZBBRYSA-N 294.420 3.242 70 20 CGID COCC(C)(C)C(=O)N1CC=C(c2ccc(F)cc2)CC1 160925288 YNWVJLHHTBPJQG-UHFFFAOYSA-N 291.366 3.114 70 20 CGID CC(C)C[C@H]1CCN(C(=O)C[C@@H](C)c2ccncc2)C1 160949499 FRNLLAQOENMMKJ-HUUCEWRRSA-N 274.408 3.470 70 20 CGID O=C(NO[C@@H]1CCCCO1)Nc1cc(F)ccc1Cl 159452415 IDQJKXDAWKUIKB-LLVKDONJSA-N 288.706 3.059 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@H]2C[C@@H]2C)C1 159528233 OHZHKVQVCWFOPC-SRVKXCTJSA-N 261.390 3.417 70 20 CGID CCCOc1cccc(CCNC(=O)C2[C@@H]3CCC[C@@H]23)c1 159724457 AVYCKIRQTAWFTJ-HZPDHXFCSA-N 287.403 3.180 70 20 CGID C[C@@H](CCn1cccn1)Nc1ccccc1N1CCCC1 159363128 DJJXRWZLFQAGOJ-HNNXBMFYSA-N 284.407 3.374 70 20 CGID O=C(Nc1cccnc1)N(Cc1ccccc1F)C1CC1 159788149 MCKKZBANTOGHFM-UHFFFAOYSA-N 285.322 3.417 70 20 CGID O=C(N[C@H]1CCCc2sccc21)c1ccc(F)cn1 160304827 XDYIQHAJPNCQBM-NSHDSACASA-N 276.336 3.090 70 20 CGID Cc1cc(NCCCC(=O)OC(C)C)nc(C(C)C)n1 160258572 PTBRLFQUQBOIHU-UHFFFAOYSA-N 279.384 3.052 70 20 CGID O=C(/C=C\c1ccc(Cl)cc1)NCCc1nccs1 216982000 LHMJRPCZVPECPS-UTCJRWHESA-N 292.791 3.169 70 20 CGID CCO[C@@H]1C[C@H](N[C@@H]2CCN(C)[C@H](C)C2)C1(CC)CC 161292404 SMUUOFWNQHWKHP-LVQVYYBASA-N 282.472 3.043 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)c3ccc(C)n3C)c2C)o1 161393415 SLUANEYJMXHXAU-UHFFFAOYSA-N 298.346 3.186 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cc(Cl)c2c(c1)OCO2 161424684 FEFCAYBYMUQMLC-DTORHVGOSA-N 281.739 3.082 70 20 CGID Cc1noc(C)c1N(C)C(=O)Nc1cc(F)c(F)cc1F 160189615 SWOFHLNIEZOPPT-UHFFFAOYSA-N 299.252 3.377 70 20 CGID C[C@@H]1CC[C@@H](CC(=O)N(C)c2ccc3c(c2)OCO3)C1 160226856 UCWUWTYAQRLJRH-VXGBXAGGSA-N 275.348 3.204 70 20 CGID Cn1ccc(CNC(=O)c2occc2-c2ccc(F)cc2)c1 160427801 CFUUKARMBMPROY-UHFFFAOYSA-N 298.317 3.354 70 20 CGID O=C(c1ccc[nH]1)c1cc(Cl)ccc1NC(=O)C1CC1 160611548 MGBAJASLDIKEIE-UHFFFAOYSA-N 288.734 3.248 70 20 CGID CCN(C(=O)C[C@H](C)c1ccncc1)c1nc(C)cs1 160747006 XGNBKOOTXCNZEN-NSHDSACASA-N 289.404 3.393 70 20 CGID CCCC1(CNC(=O)[C@@H](C)Sc2ccccn2)CC1 160752076 PFTSWICJQULYND-GFCCVEGCSA-N 278.421 3.259 70 20 CGID COc1ccc(CCCC(=O)Nc2cccc(F)n2)cc1 160774943 FSCFEMKPUQRXID-UHFFFAOYSA-N 288.322 3.191 70 20 CGID CC(C)c1cc(=O)n(CCOc2cccc(Cl)c2)cn1 160805011 DIMVNMRTQPJTPU-UHFFFAOYSA-N 292.766 3.099 70 20 CGID CCC[C@H](N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 160987767 ADHGPSZDZTWJFU-KCJUWKMLSA-N 289.206 3.298 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CCCC[C@@H]1C 159464788 VVWKTQJZZLGOIR-NSHDSACASA-N 285.347 3.060 70 20 CGID CCc1ccccc1NC(=O)N[C@@H](CC)[C@@H]1CCCO1 159522453 JJONILMEGUYFMX-ZFWWWQNUSA-N 276.380 3.328 70 20 CGID CN(C)Cc1ccc(C(=O)Nc2ccccc2N(C)C)cc1 159993447 VQERGZUMJSPZOY-UHFFFAOYSA-N 297.402 3.067 70 20 CGID C[C@@]1(NCc2ccc(-c3ccc(F)cc3)o2)CCOC1 160184350 SNSBCBBZMULYDJ-MRXNPFEDSA-N 275.323 3.354 70 20 CGID COc1cc(NC(=O)NC2CCCCC2)ccc1F 160230360 HTLBZWRCSBJOOI-UHFFFAOYSA-N 266.316 3.289 70 20 CGID CC(C)CCOC(=O)c1ccccc1OC(F)F 217484504 XWIIWHRWYYAYSO-UHFFFAOYSA-N 258.264 3.491 70 20 CGID C[C@@H](c1ccc(Cl)cc1)N(C)C[C@H](O)C1CC1 160868007 PPMOFXBYUXIAKP-HZMBPMFUSA-N 253.773 3.104 70 20 CGID Cn1ncc2c1CCC[C@H]2NC[C@H]1CCc2ccccc21 161006094 NCABOFDQVJZGCC-RHSMWYFYSA-N 281.403 3.117 70 20 CGID Cc1cccc(C(=O)NC[C@H]2CCCN2CC(C)C)c1C 160603243 KLNOOCZOAQEJTA-MRXNPFEDSA-N 288.435 3.154 70 20 CGID CCc1ccc(C(C)(C)C(=O)N[C@@H](CO)CC(C)C)cc1 160759688 WKXQFSHQRZGCGA-MRXNPFEDSA-N 291.435 3.050 70 20 CGID CC[C@@H](NC(=O)C[C@@H](C)SC)c1c(C)noc1C 160782108 VUXUZDRUWYSTEN-LDYMZIIASA-N 270.398 3.000 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@@H]1Cc2ccccc2O1 159958313 DICUEQOGWOHDTB-ZFWWWQNUSA-N 299.395 3.245 70 20 CGID CN(CCc1c(F)cccc1Cl)C[C@H]1CCC[C@@H]1O 159590667 NAMGFTUIAMHPBJ-ABAIWWIYSA-N 285.790 3.114 70 20 CGID Fc1cc(Cl)cc(CNCCCN2CCCCC2)c1 160817007 VBPGSZLOGKIMFN-UHFFFAOYSA-N 284.806 3.445 70 20 CGID C[C@@H](NC[C@@H](C1CCCCC1)N(C)C)c1cncs1 160400058 DFBNFTWJTUHQSE-OCCSQVGLSA-N 281.469 3.304 70 20 CGID CC(C)n1cc(NC(=O)N(CC2CC2)CC2CC2)cn1 161503872 NOZOPXGEWAZPBW-UHFFFAOYSA-N 276.384 3.118 70 20 CGID O=C(CC[C@H]1CCCO1)N[C@H]1CCCc2sccc21 160139426 RKJMZYZETKVFEV-YPMHNXCESA-N 279.405 3.201 70 20 CGID CO[C@@H](C)CCC(=O)N[C@H]1CCCc2sccc21 160163275 NSGFRDWFYPTBKA-JQWIXIFHSA-N 267.394 3.057 70 20 CGID Cc1ccc2c(c1)N(C(=O)C[C@@H](C)c1ccncc1)CC2 160278701 SUMHUYDJUOPDQC-CQSZACIVSA-N 280.371 3.473 70 20 CGID CC(C)[C@H]1CCCC[C@H]1Nc1ccc(OCC(N)=O)cc1 160306933 FYJSPEOLCRUCDN-HZPDHXFCSA-N 290.407 3.177 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)c1nc2ccccc2c(=O)[nH]1 160527126 NVLLLRQATRQASO-OLZOCXBDSA-N 287.407 3.352 70 20 CGID COc1cc(CNC(=O)N2CC[C@@H](C)[C@H](C)C2)ccc1C 160862517 NHGDSIIBELVBJO-TZMCWYRMSA-N 290.407 3.191 70 20 CGID C[C@@H](CN1CCCCC1)NCc1cccc2c1NCCC2 159370055 JWRBKWAEGKUBOD-HNNXBMFYSA-N 287.451 3.009 70 20 CGID Cc1ccc(NC(=O)[C@@H]2CCCCO2)c(Cl)c1 159381750 URNAPVBCOIJULS-LBPRGKRZSA-N 253.729 3.156 70 20 CGID CC(C)(C)c1ccc(OCCCS(=O)(=O)Cl)cc1 100495541 VKPCJGTUSWPURD-UHFFFAOYSA-N 290.812 3.322 70 20 CGID CC1(C)CC(Nc2nccn3cnnc23)CC(C)(C)C1 159386835 JVPYJJVCGMOQEH-UHFFFAOYSA-N 273.384 3.141 70 20 CGID CC1(NCc2cncc(Br)c2)CCCC1 160566377 QZODDUXPNSFUDN-UHFFFAOYSA-N 269.186 3.266 70 20 CGID C[C@@H](CO)SCc1cc(Br)ccc1F 160771992 VXFNJVCRLBIFOY-ZETCQYMHSA-N 279.174 3.202 70 20 CGID O=S(=O)(Cl)c1ccc(F)cc1-c1ccccc1 112734375 JTDOSBZTUBWYBJ-UHFFFAOYSA-N 270.712 3.420 70 20 CGID Cc1nc(CC(C)C)c(NC(=O)NOCC(C)C)s1 161029795 FXYVFCKWGRGUJG-UHFFFAOYSA-N 285.413 3.359 70 20 CGID CCC(O)(CC)CNC(=O)CC[C@H](C)c1ccccc1 161055474 QOZYDEZYUXOESA-AWEZNQCLSA-N 277.408 3.238 70 20 CGID CCC[C@H](CCO)CNC(=O)C(C)(C)c1ccc(C)cc1 161184591 XZGFONFRDMXWNJ-OAHLLOKOSA-N 291.435 3.188 70 20 CGID CCSCc1cccc(NC(=O)CCNC(C)C)c1 161480505 VFRGJTROTDJSME-UHFFFAOYSA-N 280.437 3.266 70 20 CGID Cc1ccc(-c2cncc(C(=O)NCC(F)(F)F)c2)cc1 160895799 IGFLUVWODRQJHJ-UHFFFAOYSA-N 294.276 3.349 70 20 CGID CCc1ccc([C@H](CO)Nc2cnc3ccccc3n2)cc1 160916994 JSKWTLLTAYNOQW-KRWDZBQOSA-N 293.370 3.338 70 20 CGID CC(C)[C@H](N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 160988740 PDMJOGAOQKUYLA-PELKAZGASA-N 289.206 3.154 70 20 CGID CCOCCC1(CNC(=O)[C@H](SCC)C(C)C)CC1 159426482 PQFYPJRZUXRNSY-CYBMUJFWSA-N 287.469 3.087 70 20 CGID CC(C)CONC(=O)Nc1ccc(OC(C)C)cc1F 159727359 MXEBBWICPBYJPO-UHFFFAOYSA-N 284.331 3.322 70 20 CGID Cc1cc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c[nH]c1=O 159397172 MMFVCOJBNQYFJQ-BFHYXJOUSA-N 288.391 3.228 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)c2ccccn2)C1 159584599 OLZSRJRIAFRDQX-GFCCVEGCSA-N 284.384 3.470 70 20 CGID CC[C@@H](CSC)N(C)c1nc(Cl)cs1 160140850 JXHVITIQJOEBQN-ZETCQYMHSA-N 250.820 3.374 70 20 CGID C[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1c(F)cccc1F 218438255 GYCGUJHPUYOTQT-TYNCELHUSA-N 283.362 3.414 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)NCC1(CCOC)CC1 161109421 XUEFPDQVWSJFAG-GJZGRUSLSA-N 296.455 3.413 70 20 CGID CCCn1ccc2ccc(NC(=O)CCNC(C)C)cc21 161281682 IKTNOUABNNCEEL-UHFFFAOYSA-N 287.407 3.378 70 20 CGID CC(C)C(=O)Nc1cccc(OCc2nccs2)c1 161346522 UOFGZABKBYJHCZ-UHFFFAOYSA-N 276.361 3.317 70 20 CGID CC[C@@H](NCCN(C)Cc1ccc(F)cc1)C1CC1 160142365 GBUWHDFASOQBHK-MRXNPFEDSA-N 264.388 3.036 70 20 CGID CN(Cc1cccn1C)C(=O)CCCc1cccs1 160438404 GKJCPQMHGSSIKK-UHFFFAOYSA-N 276.405 3.068 70 20 CGID Cc1ccc(OC(F)F)c([C@H](C)NCC(C)(C)O)c1 160604829 PUNHSQUMXIOFAK-JTQLQIEISA-N 273.323 3.018 70 20 CGID CC(C)(C)[C@@H]1CCN(CC(=O)c2ccccc2F)C1 160726171 FWBOXHPJYPPDDI-GFCCVEGCSA-N 263.356 3.376 70 20 CGID CCC(=O)c1cccc(NC(=O)C2[C@@H]3CCC[C@@H]23)c1 160735088 VMOGYYDRLQKCOJ-CHWSQXEVSA-N 257.333 3.264 70 20 CGID C[C@@H](CO)SCc1ccc(Br)cc1 160755491 VPHMBJSVNPHECU-QMMMGPOBSA-N 261.184 3.063 70 20 CGID COc1c(Cl)cccc1NC(=O)[C@@H]1CC1(C)C 160807988 HPMGGJJYZUQVGT-QMMMGPOBSA-N 253.729 3.333 70 20 CGID CCn1cc([C@H](C)N[C@@H](CCCO)c2ccccc2)cn1 160812840 JMHOHANQQXIYOV-YOEHRIQHSA-N 287.407 3.067 70 20 CGID CCc1ccc(CN(C)Cc2ccc(OC)cc2OC)o1 160833714 VPAIQNYJZUTLEH-UHFFFAOYSA-N 289.375 3.491 70 20 CGID Cc1ccccc1OCCCn1cnc(C(C)C)cc1=O 160882558 SVQLVLYMUANXCL-UHFFFAOYSA-N 286.375 3.144 70 20 CGID COCCC1(CNC(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C)CC1 160999845 UKUILHQBCKWUSD-KFWWJZLASA-N 294.439 3.166 70 20 CGID CCc1noc(C)c1CNc1ccc(OC)cc1C 159434123 BUEXBNUVLXQKMM-UHFFFAOYSA-N 260.337 3.475 70 20 CGID CCOc1ccccc1N(C)Cc1cnc(C)s1 159435232 MZBNRBINONBERV-UHFFFAOYSA-N 262.378 3.487 70 20 CGID CC(C)CCO[C@H](C)C(=O)N[C@@H]1CCOC2(CCCC2)C1 159458971 CANRVBCEFRVBFX-HUUCEWRRSA-N 297.439 3.046 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)Cc2cccnc2)C1 159499702 NMWBGMICCGUZMS-ZDUSSCGKSA-N 298.411 3.399 70 20 CGID CC(C)[C@H](C)CC(=O)N(C)CCOCc1ccccc1 159501066 YVGSOJADBRNZMW-OAHLLOKOSA-N 277.408 3.344 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc2ccccc2[nH]1 159582344 RFASIZRSPDYMFH-WCQYABFASA-N 256.349 3.476 70 20 CGID Nc1cc(F)cc(C(=O)OCCCc2ccccc2)c1F 217923413 QYNMFEYFRJNBRZ-UHFFFAOYSA-N 291.297 3.337 70 20 CGID C1CCN2CC[C@@H](NC3C4CC5CC(C4)CC3C5)[C@H]2C1 217690323 IUNGRGJVDADTQQ-RFIAZXKJSA-N 274.452 3.028 70 20 CGID CC1CCC(N(C)C[C@H](O)Cc2ccccc2)CC1 218757774 VFYCVQDXOZULII-BDVYOWHSSA-N 261.409 3.101 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cccnc1Cl 161047758 ZCNHJGPIAFKNQF-UPJWGTAASA-N 281.831 3.258 70 20 CGID COCCC1(CNC(=O)N(C)C2CCCCCC2)CC1 161061219 GXIUFJPHHHEGDY-UHFFFAOYSA-N 282.428 3.167 70 20 CGID Cc1ccccc1[C@@H](C)NC(=O)N[C@@H]1C=CCCC1 161345558 NBFDNDTZIRMHDV-ZIAGYGMSSA-N 258.365 3.464 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)Cc1ccncc1 160336610 UESBNHFAJDBONE-KBPBESRZSA-N 286.400 3.214 70 20 CGID COc1ccc(CCCN(C)C(=O)[C@@H]2CC2(C)C)cc1 160387795 NNSLXISKGKCHCR-HNNXBMFYSA-N 275.392 3.132 70 20 CGID CC(C)(C)c1nc(CCNC(=O)C2=CCCC2)cs1 160708129 VNTBJMOJOMWYEW-UHFFFAOYSA-N 278.421 3.210 70 20 CGID CCOCCC1(C(=O)NCc2ccc(F)c(C)c2)CCC1 160751433 LCEKIQZYGZAVGT-UHFFFAOYSA-N 293.382 3.347 70 20 CGID CCCC(C)(C)NC(=O)Nc1cc(C(=O)OC)cs1 160805060 WSUQOINVCLQWDM-UHFFFAOYSA-N 284.381 3.235 70 20 CGID CC[C@@H](NC(=O)C1=CCCC1)c1ccc(OC)cc1 159496270 OCSLTRKSNXODDN-OAHLLOKOSA-N 259.349 3.373 70 20 CGID CCCCN(C(=O)[C@H](C)N)[C@H](CC)c1ccccc1 159781307 NOOFOWZBYWXUKV-DZGCQCFKSA-N 262.397 3.114 70 20 CGID CCCn1nccc1CN[C@H](C)c1ccc(OC)cc1 160171953 YGVSTHFAANEQJW-CYBMUJFWSA-N 273.380 3.153 70 20 CGID Cc1ccccc1N(CC(=O)N[C@@H](C)C(C)C)C(C)C 216924556 RBHOVZYIARHMGR-HNNXBMFYSA-N 276.424 3.371 70 20 CGID c1nc(CNCC2C3CC4CC(C3)CC2C4)cs1 216843729 LGTYDVMFHAQSQE-UHFFFAOYSA-N 262.422 3.305 70 20 CGID CC[C@@H](NC(=O)c1cc(C(C)C)[nH]n1)c1c(C)noc1C 160544954 KCBJMWRIODVMRB-LLVKDONJSA-N 290.367 3.019 70 20 CGID CC(C)[C@H](CCO)NC(=O)C[C@@H](C)C1CCCCC1 160760160 LUAWXOXZKIYPIU-HIFRSBDPSA-N 269.429 3.116 70 20 CGID Cc1cccc([C@H](C)NC(=O)[C@H](N)Cc2ccccc2)c1C 160834768 GUQUXLVFFVUZTM-MAUKXSAKSA-N 296.414 3.051 70 20 CGID CCNc1nc(C(=O)N2CCC[C@@H](CC(C)C)C2)cs1 160926031 AQJMQWPOYZCAIE-LBPRGKRZSA-N 295.452 3.473 70 20 CGID CCCOc1cccc(C(=O)NCC2(C3CC3)CC2)c1 159914317 DVUSYLPDHHVVFJ-UHFFFAOYSA-N 273.376 3.395 70 20 CGID CCOC(CCN[C@@H]1CCCc2ccccc21)OCC 159534222 FOBMWAUSEAAFMM-MRXNPFEDSA-N 277.408 3.443 70 20 CGID CC(C)(C)CCC(=O)NCCNC1CCCCCC1 159729995 DYECHOSIQSFFJR-UHFFFAOYSA-N 268.445 3.241 70 20 CGID CC1(C)C[C@H](Nc2nnc(C(C)(C)C)s2)CCO1 160722182 AWOAXMODQJJYIB-SECBINFHSA-N 269.414 3.205 70 20 CGID CCc1ccc(CNCc2nn(C)c3ccccc23)cc1 218165409 VDNNOJXUDOCIBT-UHFFFAOYSA-N 279.387 3.426 70 20 CGID CC(C)(C)C[C@H](CO)Nc1ccc(Br)cn1 161456416 YEEFUOCJGWZVOU-SNVBAGLBSA-N 287.201 3.053 70 20 CGID CC[C@H](C)N(C)CCNCc1ccc(OC(F)F)cc1 217384341 YKGHCMVTRQWCJG-LBPRGKRZSA-N 286.366 3.108 70 20 CGID O=C([C@H]1CCCCO1)N(Cc1ccc(Cl)cc1)C1CC1 161014325 XFOUZZCBQKLTOL-OAHLLOKOSA-N 293.794 3.400 70 20 CGID CC[C@@H](NCCCOc1c(C)cccc1C)[C@@H]1CCOC1 161237267 XWXNVRIGADZVLK-IAGOWNOFSA-N 291.435 3.477 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1oc(C)nc1C 161322737 VZBNSVKTWBOXEE-STQMWFEESA-N 264.369 3.332 70 20 CGID CC1(C)CCCN(c2ncnc3c2cnn3C(C)(C)C)C1 161424329 PZRHUVXEHFZNGN-UHFFFAOYSA-N 287.411 3.208 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)CC2C[C@@H]3CC[C@H](C2)N3)C1 161474229 YLIKYHWCXPLZIQ-MGNMYUMUSA-N 292.467 3.192 70 20 CGID CC[C@@H]1CCCC[C@@H]1NC(=O)Cc1c(C)noc1Cl 160102607 FFCKKOKJFRFYLT-PWSUYJOCSA-N 284.787 3.264 70 20 CGID CSc1cc(C)ccc1CNC(=O)NC[C@H](C)SC 160197189 OPCKRWJQCBVPJV-NSHDSACASA-N 298.477 3.268 70 20 CGID CSC[C@@H](CCO)N[C@H](C)c1cc2c(s1)CCCC2 160240866 WIHWFTPNBXUXLD-DGCLKSJQSA-N 299.505 3.392 70 20 CGID CC(=O)c1csc(NC(=O)c2ccc(C(C)C)nc2)n1 160246180 NXVCLTYPYDTMKP-UHFFFAOYSA-N 289.360 3.116 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(C(=O)OC)c(F)cc1F 160845338 BTFGUUUVOVWSMT-RFAUZJTJSA-N 297.301 3.126 70 20 CGID CN(C)CC(=O)N[C@H](c1cccc(Cl)c1)C1CCCC1 159809095 KKOYIMDJXFOIKN-INIZCTEOSA-N 294.826 3.249 70 20 CGID Cc1nnc(-c2cccc(N[C@H](C)CCn3cccn3)c2)o1 159464755 OFRRZENVOZHNES-GFCCVEGCSA-N 297.362 3.132 70 20 CGID COCCC(=O)O[C@@H](C)c1ccc(F)c(C(F)(F)F)c1 159475075 IVCZZYJFDMEERY-QMMMGPOBSA-N 294.244 3.485 70 20 CGID CC[C@@H](N[C@@H](C)c1ccc(OC(C)C)cc1)C(=O)OC 159489391 JIEDODWTHFIJPB-SWLSCSKDSA-N 279.380 3.076 70 20 CGID CC(C)(C)OC(=O)NC12CC([B-](F)(F)F)(C1)C2 1535543433 MKTDTUMYRMSRPO-UHFFFAOYSA-N 250.049 3.035 70 20 CGID COC[C@H](NC[C@H](C)COCc1ccccc1)C(C)C 161307906 XKGANAGHGNJJOF-RDJZCZTQSA-N 279.424 3.100 70 20 CGID CCO[C@@H]1C[C@@H](NCc2cccc3[nH]ccc23)C1(C)C 217891791 TXMZMXBRQFJCLE-HZPDHXFCSA-N 272.392 3.461 70 20 CGID C[C@@H](c1cc(F)ccc1F)N(C)C(=O)[C@H]1CCCCO1 161165768 RGDTYCCEPRGFRB-IINYFYTJSA-N 283.318 3.053 70 20 CGID COC(=O)c1cccc(CNc2nccc3occc23)c1 161224600 IAZJGPJVAYHAQA-UHFFFAOYSA-N 282.299 3.227 70 20 CGID Brc1cc(Cn2ccnc2)c2ncccc2c1 161312839 IVJNZKXETOSQMS-UHFFFAOYSA-N 288.148 3.242 70 20 CGID CCOCC(=O)N1CCCC[C@H]1CCCc1ccccc1 161364146 NMACQPDXVHXWIF-KRWDZBQOSA-N 289.419 3.427 70 20 CGID C[C@@H](Cc1ccc(F)cc1)NC[C@@](C)(O)c1ccsc1 160014361 JHEIASYAXTUVBF-BLLLJJGKSA-N 293.407 3.316 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@H]1COc2ccccc21 160035306 OLOTZRGMOQNBPT-KBPBESRZSA-N 299.395 3.418 70 20 CGID c1ccc2oc(N[C@@H]3CCO[C@@H](C4CC4)C3)nc2c1 160318945 NEVJKAIEQJQXEZ-BXUZGUMPSA-N 258.321 3.197 70 20 CGID CC[C@@H](CN[C@@H](C)C1CCOCC1)Oc1ccccc1F 160341084 MKOUXRHNUAAZLC-ZFWWWQNUSA-N 295.398 3.388 70 20 CGID CCc1nn(C)c(CC)c1CN(C)Cc1cccc(F)c1 160474149 ZPUPSVZPDCSTCO-UHFFFAOYSA-N 289.398 3.316 70 20 CGID CCC[C@@H](C)CC(=O)N(C)c1ccc2c(c1)OCO2 160582775 JVZMKLOKVYYLTQ-LLVKDONJSA-N 263.337 3.204 70 20 CGID Cc1ccc(CCCC(=O)N(C)Cc2cccn2C)s1 160584765 ZNOBGAQSFDAVPP-UHFFFAOYSA-N 290.432 3.376 70 20 CGID CCCCn1ncc(C(=O)N(CCC)CCC)c1C 160769068 HALPRTHTJBOWBA-UHFFFAOYSA-N 265.401 3.254 70 20 CGID CC(C)CSCCCNC(=O)C[C@@H]1C=CCC1 160874392 CWYAUAAUJGCYQQ-CYBMUJFWSA-N 255.427 3.238 70 20 CGID COc1cc(C)ccc1NC(=O)NC1C[C@@H](C)O[C@H](C)C1 159801824 RGNYRJOSGBJHHO-VXGBXAGGSA-N 292.379 3.081 70 20 CGID Cc1cc(F)ccc1C(=O)N[C@H](C)Cc1ccc(O)cc1 159445012 QEROWEAIMHJPBT-GFCCVEGCSA-N 287.334 3.201 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)c2cocn2)C1 159650872 ZGGRISFFWWGQHW-SNVBAGLBSA-N 274.345 3.063 70 20 CGID C[C@H]1C[C@@H]1C(=O)Nc1cc(F)ccc1OC(F)F 159497815 FISZGPSONBDLGW-XPUUQOCRSA-N 259.227 3.022 70 20 CGID CC(C)C(=O)NCCCN[C@H]1CCCCc2ccccc21 159973298 ZHIHUYJYMNVLOC-KRWDZBQOSA-N 288.435 3.206 70 20 CGID CCCn1c(C)nnc1CN(C)[C@@H]1CC[C@H](SCC)C1 159978077 NWHXHOSZWOAFIW-KGLIPLIRSA-N 296.484 3.103 70 20 CGID CC[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)C(=O)OC 159513970 FFSZZRJEONIMIV-SKDRFNHKSA-N 289.297 3.308 70 20 CGID CCCC1(CNC(=O)c2cccc3cc[nH]c23)CC1 160836981 MPNQVNNWJCAVHO-UHFFFAOYSA-N 256.349 3.478 70 20 CGID Cc1cccc(CCNC(=O)NCCc2cccc(C)c2)c1 217414425 BTMCOYDHCTWPJP-UHFFFAOYSA-N 296.414 3.388 70 20 CGID CN(CCCN1CCCCC1)CCc1cccs1 161305375 LOAPZTUZFLJADP-UHFFFAOYSA-N 266.454 3.098 70 20 CGID CCCN(Cc1c(C)nc2ccccn12)CC1CC1 160421068 OXUFRASWLHLTNJ-UHFFFAOYSA-N 257.381 3.265 70 20 CGID c1ccc2c(CNCc3ccc4c(c3)OCO4)coc2c1 161065895 IIOZUQOVNRVXIE-UHFFFAOYSA-N 281.311 3.451 70 20 CGID Cc1cccc([C@@H](C)NC(=O)[C@H]2CCC(=O)C[C@@H]2C)c1C 160097050 UCMQGLQLPJPZSC-BJJXKVORSA-N 287.403 3.486 70 20 CGID CS[C@H](C)CC(=O)Nc1cccc(-c2nccn2C)c1 160322081 HQBVAKZXDOMKKN-LLVKDONJSA-N 289.404 3.167 70 20 CGID CC(C)c1ccc(OCCN[C@@H](C)[C@H]2CCOC2)cc1 160329274 XFUDZILLZUGMGG-HOCLYGCPSA-N 277.408 3.203 70 20 CGID C[C@H]1CCN(C(=O)[C@@H]2CCCCO2)c2ccccc2S1 160355170 GNXLFSCNANGSCE-JSGCOSHPSA-N 291.416 3.473 70 20 CGID Cc1cccc2c(=O)n(CC(=O)CCC3CCCC3)cnc12 160415771 QEFHVNRKQZTBMX-UHFFFAOYSA-N 298.386 3.244 70 20 CGID CN(CCC1CC1)C(=O)Nc1ccc(Br)nc1 160544791 WKXSIJNENDVWSN-UHFFFAOYSA-N 298.184 3.108 70 20 CGID C[C@@H](CN[C@H](C)C1(C)CC1)N1CCc2ccccc2C1 159829333 JXGOXZHNKCTKGK-LSDHHAIUSA-N 272.436 3.211 70 20 CGID COc1ccnc(NC(=O)c2ccc(Cl)c(F)c2)c1 159485707 OBEULKBYYDWVRN-UHFFFAOYSA-N 280.686 3.135 70 20 CGID CC(C)CCNC(=O)[C@H](C)N[C@@H](C)c1cccc(F)c1F 159509118 MPRBZGALQJZQAV-RYUDHWBXSA-N 298.377 3.166 70 20 CGID Cc1ccc(NC(=O)N(C)CCc2nccs2)cc1C 159737842 QXVVOMXKTIDGIJ-UHFFFAOYSA-N 289.404 3.466 70 20 CGID FC(F)(F)COCCN[C@H]1CCCOc2ccccc21 159363841 CYWROWGMMSMMQR-LBPRGKRZSA-N 289.297 3.069 70 20 CGID Cc1ccc([C@H](C)NCc2cnn(C)c2C)cc1C 161312092 HMMJTNGWEWYCQK-ZDUSSCGKSA-N 257.381 3.196 70 20 CGID CCN(CC)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 217795026 NYHWHDCODVERDM-CHWSQXEVSA-N 296.208 3.421 70 20 CGID O=C(CC1CC1)Nc1cc(F)c(Br)cc1F 160936312 RRNOQDZEMJSCFD-UHFFFAOYSA-N 290.107 3.466 70 20 CGID CCO[C@H]1C[C@@H](NCc2ccc(C)c(F)c2)C1(C)C 217892677 CGGOGFKMJAQDHU-CABCVRRESA-N 265.372 3.427 70 20 CGID CC[C@@H](C)NC(=O)c1cccc(CN[C@H](CC)C2CC2)c1 161136574 VILGSRIAANAANN-CXAGYDPISA-N 288.435 3.493 70 20 CGID C[C@@H]1CCCN(Cc2csc(NC(=O)C3(C)CC3)n2)C1 161363490 WMMAJQXZNHDONL-LLVKDONJSA-N 293.436 3.114 70 20 CGID CCC(N)(CC)CNC(=O)CCCCc1ccc(C)cc1 160437548 GFDLBOIYHONVCH-UHFFFAOYSA-N 290.451 3.342 70 20 CGID CC[C@H](C)[C@H](NCc1scnc1C)C(=O)OC(C)(C)C 160951849 DXQUDFGKYBVKJB-GWCFXTLKSA-N 298.452 3.298 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 159804404 HRQMENLZFSXATB-RHSMWYFYSA-N 286.375 3.188 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cc(F)ccc1NC(C)C 159619407 GMQGXTJSLPGXAF-LLVKDONJSA-N 282.359 3.400 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 159850137 LYHNDHGARFPDJX-XTQGRXLLSA-N 289.375 3.071 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)C[C@@H]1CCCCO1 159547550 GZZSFPXORFLZLF-AWEZNQCLSA-N 284.444 3.413 70 20 CGID CCc1nnc([C@@H](C)Nc2ccn(CCC(C)C)n2)o1 159941476 CRNZOVWQJAMGKX-LLVKDONJSA-N 277.372 3.048 70 20 CGID Cc1ccc(NC(=O)N(C)CCc2nccs2)cc1F 159947737 IMXNRAMZBIICLC-UHFFFAOYSA-N 293.367 3.297 70 20 CGID CC[C@@H]1CCCCN1C[C@@H](O)c1cc(OC)ccc1OC 216903142 HXVZGHJIXWCOBA-CZUORRHYSA-N 293.407 3.002 70 20 CGID C[C@@H]1CC=CC[C@H]1COC(=O)Cc1ccsc1 218498766 BOZYGRWRYXHANC-YPMHNXCESA-N 250.363 3.436 70 20 CGID COC(=O)c1csc(NC(=O)N[C@H]2CCCC2(C)C)c1 161029902 XGOMGWNSXIEIFP-JTQLQIEISA-N 296.392 3.235 70 20 CGID CCCN(CCO)Cc1cc(C)c(OC(F)F)c(C)c1 161207907 HYXMARJMMLHYTA-UHFFFAOYSA-N 287.350 3.109 70 20 CGID Cc1ccccc1CNC(=O)[C@H](C)Sc1ccncc1 160004547 MBLAMBNHRSOITH-ZDUSSCGKSA-N 286.400 3.187 70 20 CGID Cc1noc(Cl)c1CC(=O)N1C[C@H](C)c2ccccc21 160288941 HEHALGMBUXZFMU-VIFPVBQESA-N 290.750 3.329 70 20 CGID CCCN(CC(=O)OC(C)(C)C)[C@@H](C)c1ccccn1 160327651 REZHPULHJMKCTG-ZDUSSCGKSA-N 278.396 3.196 70 20 CGID Cc1nccn1-c1ccc(NC(=O)[C@H]2CCC[C@H](C)C2)cn1 160730467 RUIDTSYEFDBSBB-JSGCOSHPSA-N 298.390 3.341 70 20 CGID CCCCCOCC(=O)OCc1nc(C)sc1C 160854668 JVZKDVSCEBAOTN-UHFFFAOYSA-N 271.382 3.010 70 20 CGID COc1ccc(NC(=O)C[C@H](C)SC)c2cccnc12 160966936 NCWSTUJRCWUEGH-JTQLQIEISA-N 290.388 3.324 70 20 CGID C[C@H]1CCC[C@@H](CNC(=O)c2ccc(CN(C)C)cc2)C1 160980351 WFKYAOFPZVPQEM-GOEBONIOSA-N 288.435 3.304 70 20 CGID C[C@@H](CO)SCc1ccc(F)cc1Br 160713733 AHUCYWLHNQMBMX-ZETCQYMHSA-N 279.174 3.202 70 20 CGID FC(F)(F)c1ccc(N[C@H]2CCN3CCCC[C@@H]23)nc1 217360026 BIVVMANDXILWOB-RYUDHWBXSA-N 285.313 3.139 70 20 CGID C[C@H](N[C@H]1CCC[C@@H](O)C1)c1ccc2c(c1)CCC2 217625224 ASLPWZWRGBLTLZ-AFAVFJNCSA-N 259.393 3.129 70 20 CGID CC(C)CONC(=O)Nc1ccccc1OCC(F)F 161055602 MITIZIQYVBSHDK-UHFFFAOYSA-N 288.294 3.040 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)CCc2nccs2)o1 161361829 LPIULUVRDPRUHE-VOTSOKGWSA-N 290.388 3.013 70 20 CGID CCCn1nccc1CN[C@@H](C)c1cc(F)ccc1OC 160059692 FLPKVCQDHHRYOG-LBPRGKRZSA-N 291.370 3.292 70 20 CGID CCC(N)(CC)CNC(=O)c1sccc1C(C)C 160441945 BLEPMMJSCGBBEX-UHFFFAOYSA-N 268.426 3.119 70 20 CGID CCSCc1ccc(C(=O)NCC(N)(CC)CC)cc1 160470178 GNLZKIFITNNTEE-UHFFFAOYSA-N 294.464 3.187 70 20 CGID CC(C)(C)c1nc(CCNC(=O)C2[C@H]3CCC[C@@H]23)cs1 160653451 YPSOSCZQQMCSSL-FUNVUKJBSA-N 292.448 3.145 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)cn1 160681749 CAVDVUIHAWTJJH-OAHLLOKOSA-N 288.391 3.002 70 20 CGID O=C(CC/C=C/c1ccccc1)N[C@H]1CCN(CC2CC2)C1 159487600 FCUXPFYVHLLQLR-PYJQOMOHSA-N 298.430 3.081 70 20 CGID C[C@@H](N[C@H]1CCCc2cc(F)ccc21)C(=O)NC(C)(C)C 159539971 RGAKDKWHGVPGOX-ABAIWWIYSA-N 292.398 3.096 70 20 CGID CCCCOCCCN[C@H](C)C[C@H]1CCCCCN1 160259494 LTWAHOUDPWRRMX-HZPDHXFCSA-N 270.461 3.094 70 20 CGID C[C@H](NC(=O)CC1CCSCC1)c1cccc(O)c1 160498868 IAYOYEPJTKIBTL-NSHDSACASA-N 279.405 3.103 70 20 CGID O=C1CCC(NC(=O)c2cc3ccc(F)cc3s2)CC1 161164285 VQBPJHGHYQOAFU-UHFFFAOYSA-N 291.347 3.282 70 20 CGID CCC(CC)CNC(=O)N1CCC[C@@H]1c1ccc[nH]1 160592785 JKECBOLJEFGJCX-CQSZACIVSA-N 263.385 3.297 70 20 CGID CC1CCN(C2CCC(NC(=O)C3CC=CC3)CC2)CC1 161465784 FVRVHMJNPNEOPU-UHFFFAOYSA-N 290.451 3.112 70 20 CGID CCN(C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)[C@@H](C)C(C)C 160361075 YZBKSPCFUHDEFE-CFVMTHIKSA-N 282.428 3.020 70 20 CGID CC1(C)C[C@@H](NCc2cc(F)cc3cccnc23)CCO1 160561159 UPRKJHUAHCKIIR-HNNXBMFYSA-N 288.366 3.421 70 20 CGID Cc1cnc(C)c(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160630861 MAGNVFOYSBEVAH-JKSUJKDBSA-N 283.375 3.426 70 20 CGID CCCCOc1cccc(CN[C@@H](COC)C2CC2)c1 160838310 WKCSIBLVRXHVTJ-KRWDZBQOSA-N 277.408 3.380 70 20 CGID CCN(CC)c1ccc(NC(=O)C[C@@H](C)SC)cn1 159601632 ISANHTHBPIGNIQ-LLVKDONJSA-N 281.425 3.008 70 20 CGID Cc1cc(=O)n(C)cc1NC(=O)C[C@H]1CCCCC1(C)C 159865543 QJEWAXHDNRJPDR-CYBMUJFWSA-N 290.407 3.239 70 20 CGID CS[C@@H](C)CC(=O)NCCOc1ccc(C(C)C)cc1 159717038 ABRUHYIQHKAQTG-ZDUSSCGKSA-N 295.448 3.447 70 20 CGID CC[C@@H](C)c1cc(C(=O)Nc2ccc3c[nH]nc3c2)on1 159768104 XXKAAQAGMKCLBD-SECBINFHSA-N 284.319 3.317 70 20 CGID CCc1ncnc(N[C@@H](C)Cc2cccs2)c1F 217968960 MFYQFSGPEYNZAO-VIFPVBQESA-N 265.357 3.283 70 20 CGID CNC(=O)c1ccc(NCc2coc3ccccc23)cc1 161073937 XWUULANAFSYYQX-UHFFFAOYSA-N 280.327 3.405 70 20 CGID CS[C@H](C)CNC(=O)[C@@H](C)Cc1ccccc1Cl 161310281 BAAHPKDPQURDCO-WDEREUQCSA-N 285.840 3.386 70 20 CGID O=C(CCCOCc1ccccc1)NCC1(C2CC2)CC1 160088122 IFCAKKBQOPCTGV-UHFFFAOYSA-N 287.403 3.290 70 20 CGID O=C(Nc1ccccc1OC(F)(F)F)[C@H]1CCCCO1 160304670 MVYWNMYWHSPBSO-LLVKDONJSA-N 289.253 3.093 70 20 CGID CC[C@@H](CN[C@@H](C)c1cnn(C)c1)Oc1ccccc1F 160316877 GABHVGVUSGSCKU-JSGCOSHPSA-N 291.370 3.067 70 20 CGID Clc1cccnc1N1CCN(c2cccs2)CC1 160670976 HOUDYTMVGAMBOQ-UHFFFAOYSA-N 279.796 3.123 70 20 CGID CC1(C)CCCC[C@H]1CC(=O)N1CCOCC1(C)C 160959452 SUPAQSRKGPGTHC-ZDUSSCGKSA-N 267.413 3.230 70 20 CGID CCN(C(=O)c1cccc(-c2ncn[nH]2)c1)c1ccccc1 159868306 BWNAPHUCYBSYTR-UHFFFAOYSA-N 292.342 3.138 70 20 CGID Cc1cccc([C@@H](C)C(=O)NCC2(C3CC3)CC2)c1 159954289 LDDXRYPXXOLLPO-CYBMUJFWSA-N 257.377 3.405 70 20 CGID CCCN(Cc1ccccc1)Cc1ccnn1CC 160477735 VTJBJSWILANYIZ-UHFFFAOYSA-N 257.381 3.315 70 20 CGID C[C@H](C12CC3CC(CC(C3)C1)C2)S(=O)(=O)Cl 88251660 NUVCNDPXAPRPJY-AAWJQDODSA-N 262.802 3.160 70 20 CGID C[C@H]1CCC[C@H](CNC(=O)N2CCCCCC2)C1 218050742 ALHUGOBTAWBXRN-KBPBESRZSA-N 252.402 3.398 70 20 CGID CNc1ccccc1C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C 217857990 KHRKDUPLEVRUDC-SGMGOOAPSA-N 260.381 3.283 70 20 CGID c1ccc(C2CC(N[C@H]3CCN4CCCC[C@@H]34)C2)cc1 217690544 SXXYVJRSMPFUPQ-FOIPXRHGSA-N 270.420 3.149 70 20 CGID COc1ccc(O)c(C(=O)N2CCC[C@@H](CC(C)C)C2)c1 161051931 FCVCOCKRSAFIMU-ZDUSSCGKSA-N 291.391 3.299 70 20 CGID CCc1c(C(=O)N[C@@H](C)CC(C)C)cnn1CC(C)C 161355849 APTNVPKSKHJZBA-ZDUSSCGKSA-N 279.428 3.266 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)C2CCC(OC)CC2)o1 160050728 SROANCLBTSFMLN-VAWYXSNFSA-N 291.391 3.271 70 20 CGID CCc1noc(C)c1CSCCC(=O)NC(C)(C)C 160080144 RJDUANNJCVAHRA-UHFFFAOYSA-N 284.425 3.083 70 20 CGID Cc1cc(N[C@@H]2CCO[C@H](c3ccccc3)C2)nc(C)n1 160528698 NJTMZGSOXWXYTN-CVEARBPZSA-N 283.375 3.426 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cccc(NC(C)=O)c1C 160925753 VOFBDUAODMTROE-LRDDRELGSA-N 274.364 3.328 70 20 CGID C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)N(C)CC1CCOCC1 159645071 SDUBWJZUIAICLK-UKRRQHHQSA-N 296.455 3.269 70 20 CGID Cc1cnccc1NC(=O)[C@@H](C)Cc1ccccc1F 159390083 IWZPUMCTWVLJQG-NSHDSACASA-N 272.323 3.346 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2ccc(F)nc2)CC1 160960616 NRGFYRMMXRFFIN-UHFFFAOYSA-N 262.328 3.039 70 20 CGID CC(C)CCCNC(=O)Nc1ccn(CC(F)(F)F)n1 160299778 XDELXMMCVZAJEJ-UHFFFAOYSA-N 292.305 3.003 70 20 CGID CC[C@H](NC(=O)CCC(C)C)c1c(C)noc1C 160682043 RRVOWBFHBOZVQB-LBPRGKRZSA-N 252.358 3.295 70 20 CGID CCC[C@H](N[C@@H](C)c1cccc(F)c1F)C(=O)OCC 159485690 VXOIPEXMPOZAPB-GWCFXTLKSA-N 285.334 3.347 70 20 CGID COc1ccc(N(C)C(=O)C[C@H](C)C(C)C)cc1F 159369068 KYPRAFTYHUHDMD-NSHDSACASA-N 267.344 3.479 70 20 CGID CSCC(=O)Nc1ccc(OCc2nccs2)cc1 161282982 YLPAINGSASEPKQ-UHFFFAOYSA-N 294.401 3.024 70 20 CGID CCCCOc1ccccc1NC(=O)N[C@]1(C)CCOC1 161485798 AGQHDSMADZDYPM-MRXNPFEDSA-N 292.379 3.166 70 20 CGID C[C@H](CC(=O)Nc1ccc2nccnc2c1)c1ccncc1 160114607 MYPABCVPMKKPGG-GFCCVEGCSA-N 292.342 3.157 70 20 CGID Cc1nc(C)c(C(=O)N[C@@H]2CCCc3sccc32)o1 160384201 QENAYTFTFJXZBH-LLVKDONJSA-N 276.361 3.160 70 20 CGID C[C@@H](CC(=O)N1CCc2ccccc2CC1)c1ccncc1 160631565 YJAWQAWMFXCTHF-HNNXBMFYSA-N 294.398 3.203 70 20 CGID CCN(Cc1nccn1C)[C@@H](C)c1ccc(F)cc1 160807099 OBBLAFXPXKTXDG-LBPRGKRZSA-N 261.344 3.142 70 20 CGID CCSCC[C@@H](C)N(C)Cc1cnc2ccccn12 160904292 NZHPZCRMJWZACM-CYBMUJFWSA-N 277.437 3.298 70 20 CGID CCc1nc([C@@H](C)N[C@H](C)C(=O)OC(C)(C)C)cs1 160904944 UYTMUVYQTZEFSN-NXEZZACHSA-N 284.425 3.086 70 20 CGID Cc1cccc([C@@H](NC(=O)c2ccc[nH]2)c2ccccn2)c1 159810851 BEDAPMYKMIENBA-QGZVFWFLSA-N 291.354 3.238 70 20 CGID O=C(CCC1CC1)N[C@H](C[C@H]1CCOC1)c1ccccc1 159442984 BZSJLKTUSWMTME-NVXWUHKLSA-N 287.403 3.461 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc2[nH]ccc2c1 159930464 YSGZQSCCOMLZNI-OAHLLOKOSA-N 298.386 3.390 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)COCC2CC2)C1 159548870 VYJFPOUYTMTSMU-LBPRGKRZSA-N 291.416 3.188 70 20 CGID C[C@@H](C[C@@H](O)c1ccco1)Nc1nc(C(C)(C)C)ns1 159960874 JGORHCXONLMJRC-VHSXEESVSA-N 295.408 3.353 70 20 CGID CCOC(=O)Nc1ccc(NC2CC(OCC)C2)cc1 159826351 RVZDUWXERJCEOF-UHFFFAOYSA-N 278.352 3.234 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2CCC[C@H]3OCC[C@H]23)n1 159976867 HWWYKFOTAPBLGW-GMTAPVOTSA-N 281.425 3.205 70 20 CGID C[C@@H](CC1CC1)NCc1cncc(Br)c1 160578261 CCZPHCBUTDNIDU-VIFPVBQESA-N 269.186 3.122 70 20 CGID OCCC[C@@H](NC(C1CC1)C1CC1)c1ccccc1 160726562 GFGORNVMGZJFEC-MRXNPFEDSA-N 259.393 3.278 70 20 CGID C[C@H](N[C@@H](CCCO)c1ccccc1)c1cncs1 160751859 BAGDKMHAHUFTMW-JSGCOSHPSA-N 276.405 3.308 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccccc1O 160852128 XUBVCYOTPANCLD-ZDUSSCGKSA-N 289.375 3.004 70 20 CGID Cc1ccn2c(CN(C)Cc3ccc(C)o3)cnc2c1 160855329 MAEOVNPSFCIZME-UHFFFAOYSA-N 269.348 3.176 70 20 CGID C[C@@H](CN[C@H](C)c1ccco1)N1CCc2sccc2C1 159867218 WIRNREPQIQAGES-QWHCGFSZSA-N 290.432 3.439 70 20 CGID CCCC1CCC(NC(=O)N(C)C[C@H]2CCC[C@H]2O)CC1 159921692 ZPYHEHJKVIDROX-GYTBAZASSA-N 296.455 3.148 70 20 CGID COc1c(F)cc(NC(=O)N2CC[C@H](C)[C@@H](C)C2)cc1F 159737509 WKYCILBBGUKOAH-UWVGGRQHSA-N 298.333 3.483 70 20 CGID C[C@@H](O)CN(C)[C@@H]1CCc2c(Cl)cc(Cl)cc21 159385338 WHVGRMSKNCMNNB-AMIZOPFISA-N 274.191 3.293 70 20 CGID Cc1nc(CCN[C@H](C)c2ccccn2)sc1C 159388027 CCIAKGXZFZUJJO-LLVKDONJSA-N 261.394 3.048 70 20 CGID C[C@H](c1nc(C2CC2)no1)N(C)OCc1ccccc1 159591332 MXBJRHYTNMITBH-LLVKDONJSA-N 273.336 3.072 70 20 CGID Cc1cccc(Cl)c1NCc1nnc2n1CCCC2 217319464 ZQHSOGPLSWYVSZ-UHFFFAOYSA-N 276.771 3.188 70 20 CGID CC[C@@](C)(CCO)NCc1ccccc1C(F)(F)F 218101663 IWFJIYBQOMXWCN-ZDUSSCGKSA-N 275.314 3.346 70 20 CGID CC[C@H](NC[C@@H](C)COCc1ccccc1)[C@H]1CCOC1 161308425 SCQPJLNVFGDLST-NJAFHUGGSA-N 291.435 3.244 70 20 CGID CC[C@H](C(=O)N[C@@H]1CCOC(C)(C)C1)c1ccc(F)cc1 161374915 CQTNVBGHSFOCIO-CABCVRRESA-N 293.382 3.393 70 20 CGID CN(C(=O)CCSCc1nccs1)c1ccccc1 160157304 ZRQSTWBICXROSM-UHFFFAOYSA-N 292.429 3.429 70 20 CGID CCC[C@@H](C)CC(=O)Nc1ccc(C(=O)NC)cc1Cl 160256401 XSWHEJYQXDIREG-SNVBAGLBSA-N 296.798 3.464 70 20 CGID CC(C)(CCC(=O)NCCCF)c1ccccc1 160459014 ARKIUPMHSIFLLV-UHFFFAOYSA-N 251.345 3.220 70 20 CGID Cc1ccoc1C(=O)N[C@H]1CCOC2(CCCCC2)C1 160480525 WGNUKEJAXSGJHB-ZDUSSCGKSA-N 277.364 3.200 70 20 CGID CCN(CC)[C@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160825077 NTNPATROZMAAAU-HNNXBMFYSA-N 280.456 3.146 70 20 CGID CC(C)CSCCCNC(=O)c1cc(Cl)ccn1 160847206 RBNYBMJZFJKVQX-UHFFFAOYSA-N 286.828 3.244 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1cccc(C)c1 160966370 LUVDIBOBNUBOSX-UHFFFAOYSA-N 285.391 3.483 70 20 CGID CC(C)c1ccc(C(=O)Nc2nnc(C3CC3)s2)cn1 159645458 MVNSNIJIWVOYAI-UHFFFAOYSA-N 288.376 3.186 70 20 CGID CO[C@H](C)CC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 159917191 CROQVEVUUHTREV-RDTXWAMCSA-N 298.386 3.021 70 20 CGID CCCc1ccc(S(=O)(=O)N(C)C2CCCC2)cc1 217057285 HTYFSJSDBIJQDZ-UHFFFAOYSA-N 281.421 3.202 70 20 CGID Cc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1C 218129288 GRDZHIMHAJTXTR-IRXDYDNUSA-N 258.409 3.020 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CC1CCOCC1 161238249 SDKIZCSVZNDIJO-HUUCEWRRSA-N 267.413 3.230 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)CCCc1cccs1 161423422 AGHJWMCIRMJKDS-TXEJJXNPSA-N 251.395 3.470 70 20 CGID CCC[C@@H]1CN(C(=O)NCc2ccc(C)cc2C)CCO1 160176103 ZMFPMGTWFQIEIX-MRXNPFEDSA-N 290.407 3.014 70 20 CGID CC[C@H]1CCCCN1CCNC(=O)[C@@H](C)c1ccsc1 160247964 VDGSJKUARUSACA-ZFWWWQNUSA-N 294.464 3.232 70 20 CGID CN(Cc1cccn1C)C(=O)CC1CCCCCC1 160417969 MRGRYNATQLZYLM-UHFFFAOYSA-N 262.397 3.344 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@H]2CCC[C@H]2C)n1 160486383 XQHPXZYJBPUCOJ-OLZOCXBDSA-N 278.400 3.239 70 20 CGID C[C@@H](NCC(C)(C)O)c1cccc(-c2ccncc2)c1 160659703 MGBYASFHUQIWEJ-CYBMUJFWSA-N 270.376 3.170 70 20 CGID COCC[C@H](C)NCCCC(=O)Nc1ccc(Cl)cc1 160807886 VEPVNCBRIBKOHL-LBPRGKRZSA-N 298.814 3.073 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H](C)c2cnccn2)C1 159404100 ICDDDQNFMNVTDQ-AVGNSLFASA-N 265.426 3.192 70 20 CGID COc1ccc(CN(C)Cc2cnc3ccccn23)cc1C 159753408 NGOBVJMMFNBTSG-UHFFFAOYSA-N 295.386 3.283 70 20 CGID COc1ccccc1CCNCc1cc(F)cc(F)c1 159586196 AMSGEKDOQHUZOW-UHFFFAOYSA-N 277.314 3.306 70 20 CGID CCOC(=O)CN(C(=O)c1cccc(C)c1Cl)C(C)C 160405397 CECHZGKEBAQZGR-UHFFFAOYSA-N 297.782 3.062 70 20 CGID NCC1(Cc2nc([C@H]3CCCS3)no2)CCCCC1 160615254 LFYLZDKDAXPLJH-LLVKDONJSA-N 281.425 3.089 70 20 CGID C[C@@H]1CCCC[C@H]1NC(=O)c1c[nH]nc1-c1ccccc1 217141098 ZXNLQWGOVFFGPN-IUODEOHRSA-N 283.375 3.385 70 20 CGID Cc1ccc(CN(C)CCCN2CCCCC2)s1 160880365 QIKZIDDETTZGDP-UHFFFAOYSA-N 266.454 3.364 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccccc2)c1C 161132437 AFCSXHDMZKVAMJ-UHFFFAOYSA-N 257.337 3.162 70 20 CGID CC(C)COc1ccccc1NC(=O)N[C@@]1(C)CCOC1 161415544 INUWTZULUAXCCO-INIZCTEOSA-N 292.379 3.022 70 20 CGID CCc1ccc(C2=CCN(Cc3n[nH]c(CC)n3)CC2)cc1 160241851 LJHZZLZTGGHVAY-UHFFFAOYSA-N 296.418 3.219 70 20 CGID COCCN(CC(F)F)C(=O)c1ccc(Cl)cc1C 160375887 ABCOCIAEQBTAQG-UHFFFAOYSA-N 291.725 3.002 70 20 CGID CC[C@H](NC(=O)c1ccc(C)cc1)c1c(C)noc1C 160624156 UPDYCVVOGCGOPW-AWEZNQCLSA-N 272.348 3.481 70 20 CGID CN(Cc1cccn1C)C(=O)Cc1cccc2ccccc12 160668089 TVDJIKXKZYKPNH-UHFFFAOYSA-N 292.382 3.379 70 20 CGID c1cc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)c2cc[nH]c2c1 159572159 WVOHFQQIMWZUEM-PVAVHDDUSA-N 282.387 3.215 70 20 CGID Cc1cccc(C)c1OCCCNC(=O)NC1CCCC1 217298094 BLBYDMFDVGESHT-UHFFFAOYSA-N 290.407 3.314 70 20 CGID CCCCOCCCNC(=O)NCCc1cccc(C)c1 217399400 CLIYVFVRRXTZHL-UHFFFAOYSA-N 292.423 3.044 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](CC(C)C)c1ccccn1 160064799 YVKNTNYZBIPXCX-RDJZCZTQSA-N 277.456 3.489 70 20 CGID NC[C@H]1CCCN1C(=O)c1ccc(Oc2ccccc2)cc1 160155763 HZNRLFFYDOLXOG-OAHLLOKOSA-N 296.370 3.042 70 20 CGID Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@@H]1CCCC[C@@H]1O 160565758 YRAGODPFIURBNA-NOLJZWGESA-N 293.455 3.148 70 20 CGID Cc1cc(C)c(NC(=O)/C=C/c2cnn(C)c2C)c(C)c1 160637296 PLGJJCAEQGRYMJ-VOTSOKGWSA-N 283.375 3.306 70 20 CGID Cc1cc([C@H](C)NC(=O)N2CCO[C@@H](C)[C@@H]2C)c(C)s1 159833843 XVHSSKSHPXOPJW-SRVKXCTJSA-N 296.436 3.245 70 20 CGID O=C1[C@H](Sc2ccncc2)CCCN1c1ccccc1 159938200 VTPKTDDIDATVGK-OAHLLOKOSA-N 284.384 3.369 70 20 CGID CSc1ccccc1N[C@H](C)CCn1cccn1 159392044 VGRKDGTYMPXRTM-GFCCVEGCSA-N 261.394 3.496 70 20 CGID CCCn1nccc1CN[C@H]1CCCc2occc21 159991418 BUWLAJVVIINWNJ-AWEZNQCLSA-N 259.353 3.053 70 20 CGID OC[C@H](Cc1ccccc1)NCc1ccc(Cl)cc1F 160821899 XYTAKEJXCWESBR-HNNXBMFYSA-N 293.769 3.172 70 20 CGID CC[C@H]1CCCCN1C(=O)NCCc1cccc(F)c1 217441032 UJZZPZOVFDWREA-HNNXBMFYSA-N 278.371 3.342 70 20 CGID CCCC[C@@H](C(=O)OC)N1CC[C@@H](c2ccccc2)C1 218202778 LVZZMGVXSHNERB-CVEARBPZSA-N 275.392 3.208 70 20 CGID CCCCOCCNC(=O)c1cnn(C(CC)CC)c1C 161402496 BZRXRPKNIYXURU-UHFFFAOYSA-N 295.427 3.099 70 20 CGID Cc1cc(CNC(=O)C[C@H](C)c2ccc(F)cc2F)on1 161433207 OVKCPIHBOSCTHM-VIFPVBQESA-N 294.301 3.071 70 20 CGID FC(F)(F)c1ccc(N[C@@H]2CCO[C@@H](C3CC3)C2)nc1 160308006 VLXYFIDOSZJNRK-VXGBXAGGSA-N 286.297 3.470 70 20 CGID CCc1ccc([C@H](C)CC(=O)NCC(N)(CC)CC)cc1 160440604 MPSFAEDTGWHWCU-CQSZACIVSA-N 290.451 3.376 70 20 CGID Cc1ccc(C)c([S@@](=O)Cc2nccs2)c1 160631919 ZJBIBLDVAJYUHB-MRXNPFEDSA-N 251.376 3.068 70 20 CGID C[C@@H](c1cccc(Br)c1)N(C)C[C@H](O)C1CC1 160774449 RJRIDLRRQPUELS-HZMBPMFUSA-N 298.224 3.213 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2NC(=O)N1CCCCCC1 159444875 LCJGYFFAAIOMAW-INIZCTEOSA-N 287.407 3.232 70 20 CGID CC(C)c1cc(NC(=O)c2ccn(C3CCCC3)n2)[nH]n1 159662781 JFRHJEWTUXOHGW-UHFFFAOYSA-N 287.367 3.097 70 20 CGID C[C@H]1CCC[C@H](C)N(C(=O)CCCn2cccc2)C1 159676210 SSLVRXZBYDCAJK-GJZGRUSLSA-N 262.397 3.305 70 20 CGID CCc1ccccc1NC(=O)N(C)[C@@H]1CCSC1 159521420 RLWRFQKQAJWIGM-GFCCVEGCSA-N 264.394 3.218 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@H](C)C1CCC1 159543316 OIIACUXQOHUBPT-SNVBAGLBSA-N 250.317 3.444 70 20 CGID C[C@H](CCC(C)(C)C)NC(=O)C[C@@H](C)C1CCNCC1 159773055 IHVMRMSWJUHKTF-ZIAGYGMSSA-N 282.472 3.343 70 20 CGID CCOc1ccc([C@@H](C)N[C@H](COC)C(C)C)cc1OC 159970374 LKIGMUXSXJRFAQ-UKRRQHHQSA-N 295.423 3.416 70 20 CGID Cc1nn(C)c(C)c1CNc1ccc(C(F)(F)F)nc1 160069148 UGOCZLKONPGWQO-UHFFFAOYSA-N 284.285 3.063 70 20 CGID COc1ccc(NC(=O)NCC2CCCCC2)cc1OC 217585368 ITRNNDRWILAGGL-UHFFFAOYSA-N 292.379 3.406 70 20 CGID Cc1ccc(C(=O)NC2CC=CC2)c(Br)c1 159940561 VLNKGWXERSYWAV-UHFFFAOYSA-N 280.165 3.206 70 20 CGID CS[C@@H]1CCCCN(CCCN2CCCCC2)C1 161445229 LVHDGAZKXHHZLL-OAHLLOKOSA-N 270.486 3.080 70 20 CGID CC[C@@H](c1cccc(Br)c1)S(=O)(=O)Cl 88251545 PASIOQPQXNNFOL-VIFPVBQESA-N 297.601 3.469 70 20 CGID CCc1oc2ccccc2c1CNC[C@@](C)(O)CSC 217861820 AVPBZCVNHSSXMX-MRXNPFEDSA-N 293.432 3.199 70 20 CGID Cc1cc(NC(=O)[C@H](C)Cc2cccc(Cl)c2)nn1C 161171905 WCTNBJOBQSHFPC-SNVBAGLBSA-N 291.782 3.199 70 20 CGID Cc1cnc([C@H](C)NC(=O)C[C@@H](C)c2ccncc2)s1 161287654 GOMLFVJYQGSVGD-PWSUYJOCSA-N 289.404 3.218 70 20 CGID CC[C@H](N)C(=O)N(C)[C@H](c1ccccc1Cl)C(C)C 160078980 JDDJQUSKQSJOMC-KBPBESRZSA-N 282.815 3.233 70 20 CGID CCCn1nccc1CNCCCN(C)C1CCCCC1 160105326 BMHQKBXPLRAAJZ-UHFFFAOYSA-N 292.471 3.037 70 20 CGID C[C@@H]1CN(C)CC[C@@H]1NCC1(Sc2ccccc2)CC1 160487312 JBCHIOHHXHREAX-ZBFHGGJFSA-N 290.476 3.241 70 20 CGID CC1(C)C[C@H]1C(=O)Nc1nc(-c2ccccc2)ns1 160536135 BENNQEUEDDZYBN-JTQLQIEISA-N 273.361 3.190 70 20 CGID CS[C@@H](C)CC(=O)N[C@@H](C)COc1cccc(C)c1 160847323 OHVOQWUHFDXLPS-STQMWFEESA-N 281.421 3.020 70 20 CGID CCN(CC)C(=O)Cc1cccc(OCC(F)(F)F)c1 160863628 YWAWXMOXNHYKCD-UHFFFAOYSA-N 289.297 3.039 70 20 CGID CCc1cccc(CC)c1NC(=O)N[C@@]1(C)CCOC1 159464741 WVAQLXQLZQIKMZ-INIZCTEOSA-N 276.380 3.112 70 20 CGID CC[C@H](OC1CCCC1)C(=O)NCC1(C2CC2)CC1 159875922 RZSHBWGCLNJLQI-AWEZNQCLSA-N 265.397 3.031 70 20 CGID C[C@H]1Cc2ccc(F)cc2[C@@H]1NCCOCC(F)(F)F 159376867 DXPCVFWZIMOAOI-TVQRCGJNSA-N 291.288 3.228 70 20 CGID Clc1ccccc1[C@@H]1CCCN1CCn1ccnc1 159764728 GPRHCIVUGOOZJE-HNNXBMFYSA-N 275.783 3.374 70 20 CGID Cc1cc(F)c(C(=O)N(C)Cc2ccco2)cc1F 159570109 WNZGQPDEGSSVMT-UHFFFAOYSA-N 265.259 3.138 70 20 CGID COc1cccc([C@H](O)CN[C@@H](C)c2cccs2)c1 160717836 QXCGMAMTNKRDII-SMDDNHRTSA-N 277.389 3.141 70 20 CGID COc1ncccc1CNCc1cc(F)cc(Cl)c1 160891317 PMKNESFMFUPCKP-UHFFFAOYSA-N 280.730 3.173 70 20 CGID C[C@@H]1Cc2ccccc2N1C(=O)NCC1CCCC1 217575496 HJVKCDVYLJJZGI-GFCCVEGCSA-N 258.365 3.337 70 20 CGID CCOC(CN[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C)OCC 218525376 FYHZMKWZXKJAPJ-DVOMOZLQSA-N 269.429 3.190 70 20 CGID Cc1nnc(CN2c3ccccc3S[C@H](C)[C@@H]2C)o1 161146396 MQJRRLYTOLXUNT-VHSXEESVSA-N 275.377 3.267 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)cc1C 160936026 ZLXCXHJSLOXBJG-CVEARBPZSA-N 288.391 3.383 70 20 CGID CCCCn1ncc(C(=O)N[C@@H]2CCCC[C@@H]2C)c1C 159636648 JKNHUJKGEUJGTJ-SWLSCSKDSA-N 277.412 3.300 70 20 CGID C[C@H](NC[C@H](C)N1CCc2sccc2C1)c1ccco1 159866948 WIRNREPQIQAGES-STQMWFEESA-N 290.432 3.439 70 20 CGID COc1cc(F)ccc1NC(=O)C[C@@H](C)c1ccncc1 159673388 QJDCLRZGBXAVOA-LLVKDONJSA-N 288.322 3.362 70 20 CGID Cc1oc2nc(CSc3ccncc3)nc(N)c2c1C 159873002 RYTQHVGAWLKRHW-UHFFFAOYSA-N 286.360 3.109 70 20 CGID COc1ccc(Cl)cc1N[C@H](C)CCn1cccn1 159388489 RPFJKOKNEAVSDQ-LLVKDONJSA-N 279.771 3.436 70 20 CGID Cc1ccc(C(=O)CCN(CC(F)F)C2CC2)cc1 159543957 KEWGTJFJXXNGJE-UHFFFAOYSA-N 267.319 3.297 70 20 CGID CC(C)(C)NC(=O)CNC1CC(c2ccccc2Cl)C1 159860165 OZBLUADDHJNXQB-UHFFFAOYSA-N 294.826 3.090 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)n1 160102255 WSRFLGZQBPLAKY-AXFHLTTASA-N 293.436 3.205 70 20 CGID CC[C@@H](C)[C@H](NCc1cc(Cl)ccc1F)C(=O)OC 160743593 WMLRIVADRFVZEB-RNCFNFMXSA-N 287.762 3.156 70 20 CGID CCOc1ccc(CNC(=O)N[C@H]2CCCC[C@H]2C)cc1 217300900 RJVYGKNJHYHWQK-CJNGLKHVSA-N 290.407 3.463 70 20 CGID Cc1ccc([C@@](C)(F)CS(=O)(=O)Cl)cc1C 1537958936 ONXUPYXUHIKVQL-NSHDSACASA-N 264.749 3.057 70 20 CGID COC(=O)c1ccc(N[C@@H]2CCC[C@H](SC)C2)nc1C 218023495 OSQJDRLCTHXSIF-NEPJUHHUSA-N 294.420 3.263 70 20 CGID CC[C@H](C)N(C)CCNCc1cnc(C(C)(C)C)s1 217394455 VEASLFWIYUGKIJ-LBPRGKRZSA-N 283.485 3.261 70 20 CGID O=C(NCCc1cccc(Cl)c1)N1CCCCC1 217457457 SYMGRTLRTBZXLB-UHFFFAOYSA-N 266.772 3.078 70 20 CGID CCOC(=O)[C@@H]1CCCN(Cc2ccc(F)c(Cl)c2)C1 218305849 QHBZMTLPSGMFBW-GFCCVEGCSA-N 299.773 3.254 70 20 CGID CCOC(=O)[C@@H]1CCCCN1Cc1cccc2[nH]ccc12 161281990 PNKOHYHPXMUWMQ-INIZCTEOSA-N 286.375 3.086 70 20 CGID Cn1nccc1CSc1nc2ccccc2n1C(F)F 161312913 HWSRKPRBMYVOSC-UHFFFAOYSA-N 294.330 3.457 70 20 CGID CCOC(=O)C1CCC(NC(=O)[C@@H]2CCC[C@H](C)C2)CC1 161347197 FSYBVMJXEALUJO-FGZQJIAISA-N 295.423 3.051 70 20 CGID COc1ccc(CS[C@H](C)CO)cc1Br 160782093 PBPKHKZIAZIRER-MRVPVSSYSA-N 291.210 3.072 70 20 CGID O=C(C1[C@H]2[C@@H]3CC[C@H](C3)[C@@H]12)N1CCc2c(F)cccc2C1 160998204 RBNHQUQOSZAFSS-BBOHWHHJSA-N 285.362 3.003 70 20 CGID CCCn1ccc2ccc(NC(=O)[C@@H]3CCCO3)cc21 159806565 XMYBVDAPNGGQFH-HNNXBMFYSA-N 272.348 3.169 70 20 CGID CC[C@H](NC(=O)Nc1ccccc1SC)[C@H]1CCCO1 159432953 VSAFPFPBOLFSDL-WCQYABFASA-N 294.420 3.488 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)Cc1cn(C)c2ccccc12 159637227 AYSRJMNMWAUBCE-BBRMVZONSA-N 284.403 3.416 70 20 CGID Cc1cc(C)cc(NC(=O)N(C)CCc2nccs2)c1 159924733 KXLSKASECSRUEB-UHFFFAOYSA-N 289.404 3.466 70 20 CGID C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc2[nH]cnc12 159575560 LZIOJLVRMWRYBZ-XUJVJEKNSA-N 283.375 3.356 70 20 CGID CC[C@H](C)[C@](C)(O)CNC(=O)CC[C@@H](C)c1ccccc1 161060426 KSHIWZLUIQTOJA-RVKKMQEKSA-N 291.435 3.484 70 20 CGID Fc1ccc2oc(N[C@H]3[C@@H]4CCO[C@@H]4C34CCC4)nc2c1 160101547 VDERYIGYLGLVMW-BPNCWPANSA-N 288.322 3.336 70 20 CGID CC(C)C[C@H]1CCCCN1CCC(=O)N1CCC[C@@H]1C 160328254 LRRYULDKBROLSB-JKSUJKDBSA-N 280.456 3.288 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@H](C)C[C@@H]1CCCO1 160669656 LWWKABRSQXZODX-YPMHNXCESA-N 281.783 3.336 70 20 CGID CCc1ccc(/C=C/C(=O)N(CC)Cc2ccccn2)o1 160897607 POSRQWKLDMONRJ-ZHACJKMWSA-N 284.359 3.299 70 20 CGID Cc1noc(NC(=O)CCc2ccc(CC(C)C)cc2)n1 159887099 XWZWUENEJNYICU-UHFFFAOYSA-N 287.363 3.148 70 20 CGID Cc1cccc([C@H](C)C(=O)NCC2(C3CC3)CC2)c1 159954410 LDDXRYPXXOLLPO-ZDUSSCGKSA-N 257.377 3.405 70 20 CGID Cc1ccoc1C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 159370107 IJWXMYMCBNBCKJ-GDBMZVCRSA-N 299.370 3.486 70 20 CGID C[C@H](CN1CCCCC1)NCc1cccc2c1NCCC2 159370159 JWRBKWAEGKUBOD-OAHLLOKOSA-N 287.451 3.009 70 20 CGID Cc1ccc([C@H](C)N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)cc1 159909332 OWRQUDGDHPQXHF-XZDPQHSOSA-N 259.393 3.459 70 20 CGID OCC1(CNCc2cccc3ccccc23)CCCC1 160092809 GSHUECCUDGEEJV-UHFFFAOYSA-N 269.388 3.482 70 20 CGID Cc1noc(C)c1CNc1nc(C(F)(F)F)cs1 160473949 BFFDDOXGFYIIMP-UHFFFAOYSA-N 277.271 3.379 70 20 CGID CCO[C@@H]1C[C@@H](N[C@H](C)c2ccccn2)C12CCC2 160833054 UWJVLICHGSEJOZ-BPLDGKMQSA-N 260.381 3.080 70 20 CGID Cc1cccc(C)c1OS(=O)(=O)Cc1ccc(F)cc1 218266318 AAGVNEIDWBYJSZ-UHFFFAOYSA-N 294.347 3.351 70 20 CGID CC1(C)CC[C@H](C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 809281023 NHXQAASLGCCFSN-JTQLQIEISA-N 299.367 3.110 70 20 CGID C[C@@H](NC[C@H]1CCc2ccccc21)C1CCOCC1 161008753 NVQKNRUSFWQHBB-CZUORRHYSA-N 259.393 3.121 70 20 CGID CC[C@@H](S[C@H](CC)c1ccc(F)cc1)C(N)=O 161339638 JYUJCWYGIBBROR-VXGBXAGGSA-N 255.358 3.274 70 20 CGID CCCC(O)(CCC)CC(=O)N[C@@H](C)c1nccs1 161459390 SPHWUHDCDWVCMM-NSHDSACASA-N 284.425 3.042 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@H]1COc2ccccc21 160035046 OLOTZRGMOQNBPT-UONOGXRCSA-N 299.395 3.418 70 20 CGID C[C@@H](CC(=O)NCCCC(C)(C)CO)c1ccccc1F 160370704 IBXZKUXCZORWRT-ZDUSSCGKSA-N 295.398 3.234 70 20 CGID O=C(NCC1(Cc2ccccc2)CC1)N1C[C@H]2CCC[C@@H]2C1 160750781 UNUSLEQHJLZZGZ-IAGOWNOFSA-N 298.430 3.451 70 20 CGID C[C@H](C(=O)NCCCNc1ccccc1)c1cccs1 159611144 GQKOUUDANCHANO-ZDUSSCGKSA-N 288.416 3.470 70 20 CGID C[C@H]1CN(c2nc(C(C)(C)C)ns2)C[C@H](C)S1 159695493 WTCLWZNHGOXGAJ-IUCAKERBSA-N 271.455 3.166 70 20 CGID CCc1noc(C)c1NC(=O)Nc1cc(C(C)(C)C)on1 159394684 HUCRGXDQJZGSOR-UHFFFAOYSA-N 292.339 3.475 70 20 CGID Cc1cc(C(N)=O)ccc1NCc1ccc(Cl)cc1F 160718732 HRCWIVMKDLOJEB-UHFFFAOYSA-N 292.741 3.499 70 20 CGID CO[C@@H]1CCCC[C@H]1N[C@@H](C)CCc1ccc(O)cc1 218276922 DTHIHADINJYXRV-IAOVAPTHSA-N 277.408 3.261 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CCC(=O)N(CC)CC 161209577 VNYHDWMSQZAWFL-LSDHHAIUSA-N 296.455 3.062 70 20 CGID Cc1cnc([C@@H](C)NC(=O)C[C@H](C)c2ccncc2)s1 161287785 GOMLFVJYQGSVGD-CMPLNLGQSA-N 289.404 3.218 70 20 CGID CCCn1nccc1CN[C@H](C)c1cc(C)ccc1OC 160022907 MDIYJDZJZWUKHR-CQSZACIVSA-N 287.407 3.461 70 20 CGID CN(C)c1ccc(C(=O)Nc2c(F)cccc2F)c(F)c1 160077732 QJYQCVFLASCDIY-UHFFFAOYSA-N 294.276 3.422 70 20 CGID CC(C)(C)NC(=O)c1cccc(NCc2ccccn2)c1 160202074 OAEMPCBHMZOKDN-UHFFFAOYSA-N 283.375 3.222 70 20 CGID CCN(C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1)C(C)C 160436195 UYVHEOHWNGDKIS-OAHLLOKOSA-N 292.379 3.117 70 20 CGID CSCC[C@@H](C)N(C)Cc1c(C)nc2ccccn12 160508502 JGUCFRIPSKBDEY-GFCCVEGCSA-N 277.437 3.216 70 20 CGID CC1CCN(C(=O)[C@H](C)c2c(F)cccc2F)CC1 160565311 VYCGWIKKTHHHOO-LLVKDONJSA-N 267.319 3.327 70 20 CGID Cc1nccc(NC(=O)NCCOCCC(C)C)c1Cl 159808878 HBEMEJBKUFJIHA-UHFFFAOYSA-N 299.802 3.228 70 20 CGID CC[C@H](NC(=O)c1ccccc1C)c1c(C)noc1C 159996436 JZAJCAGOWMQCMX-AWEZNQCLSA-N 272.348 3.481 70 20 CGID CCOCCCN1CCO[C@@H](c2ccc(Cl)cc2)C1 159425603 SPZZGBSZPXJWRW-OAHLLOKOSA-N 283.799 3.140 70 20 CGID CC(C)(CO)CN[C@H]1CCCc2c1[nH]c1ccccc21 160126759 ULIZRFAKRAIKJY-HNNXBMFYSA-N 272.392 3.153 70 20 CGID CC(C)(C)SCCCC(=O)N1CCOCC12CCC2 161183510 CIRKPZHBRXESQP-UHFFFAOYSA-N 285.453 3.080 70 20 CGID CCOc1cccc(NC(=O)N(C)[C@@H]2CCSC2)c1 161415841 ITZIQVRSITZYAX-GFCCVEGCSA-N 280.393 3.055 70 20 CGID COCCC1(CNC(=O)N[C@@H]2CC[C@H](C)C[C@H]2C)CCC1 160448870 PCPJYJBAINPKNX-RRFJBIMHSA-N 296.455 3.317 70 20 CGID O=C([C@H]1CCCCO1)N1CCC[C@@H]1c1ccc(F)cc1 160622646 LHFCZRLRQIVOEP-HUUCEWRRSA-N 277.339 3.058 70 20 CGID Cc1cccc(F)c1NS(=O)(=O)c1cccc(F)c1C 160812564 SIXCPRZBNJYPRB-UHFFFAOYSA-N 297.326 3.382 70 20 CGID CC(C)N(CCSCC(=O)Nc1ccccc1)C(C)C 160927589 CGLZIKAQTOFLFQ-UHFFFAOYSA-N 294.464 3.477 70 20 CGID Cc1noc(C)c1N(C)Cc1noc(-c2ccsc2)n1 160997705 BDOXTNXWMXPPOU-UHFFFAOYSA-N 290.348 3.039 70 20 CGID CCC(CC)NC(=O)[C@H](C)N[C@H](C)c1cccc(F)c1F 159425011 SRMHIJJZWCQBOE-MNOVXSKESA-N 298.377 3.309 70 20 CGID Cc1occc1C(=O)N[C@H]1CCCc2sccc21 159857520 DKGJTNYDAOOMAV-LBPRGKRZSA-N 261.346 3.457 70 20 CGID Cc1ccccc1[C@H](NC(=O)[C@H](C)N)C1CCC(C)CC1 159685700 QGYNQURWIBDXHI-ARMAHUPYSA-N 288.435 3.326 70 20 CGID CC(C)(CCO)NCc1ccc(F)c(C(F)(F)F)c1 160154268 UXPBWOVAGHKGOC-UHFFFAOYSA-N 279.277 3.095 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCc1noc(C(C)(C)C)n1 161433546 LHUBTFIMHASTON-NEPJUHHUSA-N 265.401 3.426 70 20 CGID C[C@H]1CC/C(=C\C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 809281110 GRAZVZIMLLZSDF-NGPGYTDTSA-N 297.351 3.030 70 20 CGID CCCCCC[C@H](C)OS(=O)(=O)C(F)(F)F 166272879 YUWDHKADIYFVQQ-QMMMGPOBSA-N 262.293 3.212 70 20 CGID CON(C)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 218121850 LPGQSCALJYICHA-BDAKNGLRSA-N 274.147 3.117 70 20 CGID CCc1ccc(/C=C/C(=O)NCC2(CCOC)CCC2)o1 161107869 JBQOAYCWHYMPLA-BQYQJAHWSA-N 291.391 3.178 70 20 CGID CC[C@@H](S[C@H]1CCN(C)C1=O)c1ccc(F)cc1F 161374847 PGZRYKZFQOGJSZ-OLZOCXBDSA-N 285.359 3.380 70 20 CGID CCCn1nccc1CN[C@@H](C)c1cc(C)ccc1OC 160022789 MDIYJDZJZWUKHR-AWEZNQCLSA-N 287.407 3.461 70 20 CGID CC[C@@H]1CCCN(C(=O)c2cc([C@H](C)CC)no2)C1 160325046 RKTPDEPKQXXKMX-VXGBXAGGSA-N 264.369 3.450 70 20 CGID Cc1nc2ccccc2nc1N[C@H]1CCO[C@H](C2CC2)C1 160404868 WKUWZLIWKORIDV-BBRMVZONSA-N 283.375 3.308 70 20 CGID C[C@@H](NC[C@@H](C1CCCCC1)N(C)C)c1cncc(F)c1 160412595 IHODBVOJARANFT-DYVFJYSZSA-N 293.430 3.382 70 20 CGID CC[C@H](C)CN(CC)CC(=O)c1[nH]c(C)c(C(C)=O)c1C 160590935 ZCSNYNJPVMQBMQ-NSHDSACASA-N 292.423 3.385 70 20 CGID CC(C)[C@@H](O)CC(=O)Nc1ccc(OC(C)(C)C)cc1 160830325 QWBHXLXFPGXMOX-AWEZNQCLSA-N 279.380 3.209 70 20 CGID CCC(C)(CC)C(=O)N1CCC(CCCN(C)C)CC1 159408218 WOGCOIINEXQHLX-UHFFFAOYSA-N 282.472 3.393 70 20 CGID Cc1ccc(C[C@@H](C)NC(=O)c2cccc3[nH]cnc23)s1 159626096 NWRLYOCUFHXTRK-SNVBAGLBSA-N 299.399 3.294 70 20 CGID CCOc1cccc(NC(=O)C[C@H]2CSCCS2)c1 159685172 VERONVFZPACWJX-ZDUSSCGKSA-N 297.445 3.263 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)Oc1ccccc1 159735495 YVSKURMDTFYEIC-NFAWXSAZSA-N 261.365 3.149 70 20 CGID CCOC(CCN[C@H]1CCCc2ccccc21)OCC 159534349 FOBMWAUSEAAFMM-INIZCTEOSA-N 277.408 3.443 70 20 CGID CCN(CC)c1ncc(CN[C@H]2CCOC(C)(C)C2)s1 160478783 DMBKLQXZDUPMQE-LBPRGKRZSA-N 297.468 3.037 70 20 CGID CC[C@H]1CCCCN1C(=O)NCCCOc1ccccc1 217299721 QATBIUBRNOIWEO-HNNXBMFYSA-N 290.407 3.430 70 20 CGID C[C@H](NC(=O)[C@H]1CCCN1C1CCCC1)c1ccccc1 217937401 VVELMJUFCUENGZ-WMLDXEAASA-N 286.419 3.271 70 20 CGID FCCCOc1cc(Br)ccc1F 160208570 LNERMDPTCFYUPS-UHFFFAOYSA-N 251.070 3.327 70 20 CGID COc1ccc(COCCCN[C@H](C)C(C)C)cc1 161070818 DKLFGDOWGXLPSC-CQSZACIVSA-N 265.397 3.236 70 20 CGID COc1ccc(NC(=O)C[C@@H]2CCC[C@H](C)C2)cc1N 161230794 WKDGMBOBHDQJSQ-NWDGAFQWSA-N 276.380 3.432 70 20 CGID CS[C@@H](C)CNC(=O)Nc1ccccc1OC(C)C 160212085 JCUCZJNYSKUNQB-NSHDSACASA-N 282.409 3.347 70 20 CGID Cc1cc2ccccc2n1CC(=O)NCC1(C2CC2)CC1 160214090 UMIQVMBXFWYHDM-UHFFFAOYSA-N 282.387 3.256 70 20 CGID CC[C@@H](NC(=O)CC1CCCC1)c1c(C)noc1C 160383690 TWKYRQHKUIQVCT-CYBMUJFWSA-N 264.369 3.439 70 20 CGID C[C@@H](NC(=O)Nc1ccccc1N(C)C)C1CCC1 160402788 QOZHOUIYPMBSQQ-LLVKDONJSA-N 261.369 3.063 70 20 CGID CCC1(CO)CCN(C(=O)c2ccc(Cl)c(F)c2)CC1 159602217 ZOZASPVCJVTGLJ-UHFFFAOYSA-N 299.773 3.104 70 20 CGID COCc1ccccc1NC(=O)NCC1(C2CC2)CC1 159873290 ORXHWKWFQYISPX-UHFFFAOYSA-N 274.364 3.145 70 20 CGID CCn1nccc1CN[C@H](C)c1ccc(OC(F)F)cc1 159920790 HJOYJEJRYRHEDC-LLVKDONJSA-N 295.333 3.355 70 20 CGID C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@H]1CCCSC1 159534053 GMLRIVQQKPLOHX-RISCZKNCSA-N 296.411 3.028 70 20 CGID COCCN(Cc1ccco1)c1nc(C(C)(C)C)ns1 159963756 GDCPSJQNVXBGFL-UHFFFAOYSA-N 295.408 3.082 70 20 CGID CCCN(C)[C@@H]1CCCN(c2ccccc2Cl)C1=O 159779630 IXFWBZKLZUWEGR-CQSZACIVSA-N 280.799 3.177 70 20 CGID CCc1ncnc(NCCc2cc(F)cc(F)c2)c1F 217999736 GUZHYJUSEWSVRE-UHFFFAOYSA-N 281.281 3.111 70 20 CGID CN(Cc1cccn1C)C(=O)c1scnc1C(C)(C)C 161009863 AWTLKLCNTHZISC-UHFFFAOYSA-N 291.420 3.051 70 20 CGID CN(Cc1cccnc1)C(=O)c1cc(F)c(Cl)cc1F 161060947 JTTCIRIQMGNXMP-UHFFFAOYSA-N 296.704 3.285 70 20 CGID Cc1cc(OCC(=O)N2[C@@H](C)CC[C@H]2C)ccc1Cl 161408133 MDUCIUTYSAOPEF-TXEJJXNPSA-N 281.783 3.427 70 20 CGID CCSc1cc(C(=O)N2[C@@H](C)CC[C@H]2C)ccn1 161483758 XUUFPENUTCAAAF-PHIMTYICSA-N 264.394 3.207 70 20 CGID C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NCC1(C2CC2)CC1 160031372 AMNLUIMHUCUJNJ-SNVBAGLBSA-N 295.329 3.039 70 20 CGID C[C@@H](Oc1ccccc1Cl)C(=O)NCC1(C2CC2)CC1 160066786 MDEOACMZCFYSHN-LLVKDONJSA-N 293.794 3.414 70 20 CGID CC[C@@H](NCCOc1c(C)cccc1C)[C@H]1CCOC1 160278107 MPUCYLAILQVNBC-JKSUJKDBSA-N 277.408 3.087 70 20 CGID Cc1cccc2nc(CN[C@H]3CCc4ccccc43)cn12 160301258 WWMZZAIRFQUJFR-KRWDZBQOSA-N 277.371 3.420 70 20 CGID CCCN(CCN(C)C)C(=O)[C@H](CC)c1ccc(F)cc1 160335742 CREUOXUYSGCJNT-MRXNPFEDSA-N 294.414 3.120 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)C[C@H]1C=CCC1 160870532 OYPFQNNVKLYRKY-RYUDHWBXSA-N 277.389 3.182 70 20 CGID Cc1occc1C(=O)N[C@@H]1CCCc2sccc21 159857396 DKGJTNYDAOOMAV-GFCCVEGCSA-N 261.346 3.457 70 20 CGID CC1(C)CCC[C@H]1NC(=O)NCC1(C2CC2)CC1 159468855 RNRUDRYPQDKQCH-GFCCVEGCSA-N 250.386 3.055 70 20 CGID CC(C)C[C@H](NCCO)c1cccc(C(F)(F)F)c1 159684188 NIFOUBYWFJGKJA-ZDUSSCGKSA-N 275.314 3.375 70 20 CGID CCCCO[C@@H](C)C(=O)NCCc1cc2ccccc2[nH]1 159684439 NNEJKZXWKHTCOF-ZDUSSCGKSA-N 288.391 3.032 70 20 CGID CSC[C@H](C)C(=O)O[C@@H](c1ccccn1)C(F)(F)F 159911079 OEFSVCGFWPKHEV-WPRPVWTQSA-N 293.310 3.227 70 20 CGID C[C@@H](C(=O)Nc1cccc([S@](C)=O)c1)c1cccs1 159739208 XLJFQAHMMKGORK-GIGQVBGESA-N 293.413 3.228 70 20 CGID CC(C)(C)c1nsc(N2C[C@H]3CCC[C@@H]3C2)n1 159938701 JWEMEMCBMXFDOX-NXEZZACHSA-N 251.399 3.072 70 20 CGID CC(C)n1nccc1C(=O)Nc1cc(CC(C)(C)C)n[nH]1 159955960 BBSFRTTVIYYUSV-UHFFFAOYSA-N 289.383 3.028 70 20 CGID C(=C/c1ccccc1)\CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 159480868 MLQNMOQZDIYCDP-TYNQKIBBSA-N 269.388 3.247 70 20 CGID C[C@@H]1CCC[C@@H](C)C1NC(=O)c1ccc(Cl)cn1 217236436 UYVPORNTGXALKC-NXEZZACHSA-N 266.772 3.290 70 20 CGID CC1(CNc2ccc(F)c(Br)c2)COC1 159874251 YTGQNXOALUYJJA-UHFFFAOYSA-N 274.133 3.037 70 20 CGID Fc1ccc(NCc2nnc3n2CCCC3)c(Cl)c1 217317936 JEPLTWNFZPDRPG-UHFFFAOYSA-N 280.734 3.019 70 20 CGID Cc1cccc(C2(C(=O)NCC(C)(C)N)CCCCC2)c1 160090836 DVJSTTLFKIRYOM-UHFFFAOYSA-N 288.435 3.050 70 20 CGID Cc1cccc(C(=O)N(C)c2ccc3c(c2)OCO3)c1C 160228700 WISSRIAGIDXODA-UHFFFAOYSA-N 283.327 3.309 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)CCOc1ccc(F)cc1 160233666 GUQKDJPFDZTQMM-ZBFHGGJFSA-N 279.355 3.099 70 20 CGID CC[C@@H](NC(=O)c1cccs1)c1c(C)noc1C 160278445 CXHNTVLSQHQBAE-SNVBAGLBSA-N 264.350 3.234 70 20 CGID CC(C)Cc1nc(C(=O)Nc2cccc(F)n2)cs1 160604503 LLUWNEWZEVRBFY-UHFFFAOYSA-N 279.340 3.128 70 20 CGID COCc1cccc(C(=O)OCc2nc(C)sc2C)c1 159476772 JZHIHGQXYCNVMQ-UHFFFAOYSA-N 291.372 3.263 70 20 CGID COc1ccc2c(c1)[C@@H](N[C@@H]1CCCSC1)CCCO2 159531255 VGDPNMCNYTXHBR-DOMZBBRYSA-N 293.432 3.394 70 20 CGID CCCn1c(C)nnc1CN(C)[C@H]1CC[C@H](SCC)C1 159978209 NWHXHOSZWOAFIW-KBPBESRZSA-N 296.484 3.103 70 20 CGID CC(C)(C)c1nc(COc2ccc3[nH]ccc3c2)no1 160069297 CVCWTCPTBIBRJN-UHFFFAOYSA-N 271.320 3.427 70 20 CGID C[C@H](c1cccc(C(F)(F)F)c1)S(=O)(=O)Cl 88251560 YSVMNOIWZBGJTF-ZCFIWIBFSA-N 272.675 3.335 70 20 CGID C[C@@H]1CCC[C@H](N[C@H](C)c2ccc(NC(N)=O)cc2)C1 217605994 RRWBVEZWLOXVGX-JMSVASOKSA-N 275.396 3.407 70 20 CGID CC(C)c1ccc(OCc2nnc3n2CCCC3)cc1 217323333 ZJSMXFQUPMBQKD-UHFFFAOYSA-N 271.364 3.317 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ncoc1C 161191246 PDVRNFOXGKMMLC-NEPJUHHUSA-N 250.342 3.024 70 20 CGID Cc1cccc(OCCN(C)C(=O)Nc2ccc(C)nc2)c1 161383873 LFUIKVNLVDWFHV-UHFFFAOYSA-N 299.374 3.241 70 20 CGID CCCCn1ncc(NC(=O)N2CCC[C@@H](C)C2)c1C 160005677 WEGNPAQUFUUPIH-GFCCVEGCSA-N 278.400 3.255 70 20 CGID CC(C)CCSCC(=O)N(C)c1ccc2c(c1)OCO2 160581266 WCVHJAHLECEOKW-UHFFFAOYSA-N 295.404 3.157 70 20 CGID Cc1cccc([C@H](C)NC(=O)[C@@H](N)Cc2ccccc2)c1C 160833963 GUQUXLVFFVUZTM-YJBOKZPZSA-N 296.414 3.051 70 20 CGID CCC1(NC(=O)Nc2ccn(CCC(C)C)n2)CCC1 160967306 BDWJDMZZNOFVSB-UHFFFAOYSA-N 278.400 3.383 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccccc1F 159405125 MBJKYGDUAMSUTM-GFCCVEGCSA-N 277.339 3.047 70 20 CGID CCOc1ccc(NC(=O)c2cccc(C)c2O)cc1F 159694149 OIGBDUUITZPUPY-UHFFFAOYSA-N 289.306 3.491 70 20 CGID CCc1oc(C(=O)OC)cc1CSc1ccncc1 159934111 MIWFDJSNVSDJMN-UHFFFAOYSA-N 277.345 3.316 70 20 CGID C[C@@H]1CN(Cc2cccc3ccccc23)CC[C@@H]1O 159469956 TUHUCALVAAKYBR-DYVFJYSZSA-N 255.361 3.043 70 20 CGID CCCn1nccc1CNc1cccc2cnccc12 160016367 PSKLCJXHZYGLLD-UHFFFAOYSA-N 266.348 3.453 70 20 CGID CCC(C)(C)NC(=O)[C@H]1C[C@H]1c1sccc1C 160573516 IXRCQXPXASKRMR-MNOVXSKESA-N 251.395 3.465 70 20 CGID CCCOC(=O)c1ccc(C(=O)OC(C)(C)C)cc1 216672098 ANQZCPWSQSQZIV-UHFFFAOYSA-N 264.321 3.209 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2nc(C)cs2)n1 160250785 HUOGONLDKFXFMT-AWEZNQCLSA-N 273.405 3.492 70 20 CGID CC[C@@H](c1ccc(Br)cc1)S(=O)(=O)Cl 88251494 CLTIOWFXQWXRME-VIFPVBQESA-N 297.601 3.469 70 20 CGID CCC[C@@H](C)CC(=O)Nc1ccc(S(=O)(=O)F)cc1 776368600 ZGJNUAFMHKRUMQ-SNVBAGLBSA-N 287.356 3.110 70 20 CGID CCCCNC(=O)N1C[C@@]2(C)C[C@H]1CC(C)(C)C2 217304875 QAMLZNKDSITKLH-DOMZBBRYSA-N 252.402 3.397 70 20 CGID CSc1ccc(CNCCNC(=O)OC(C)(C)C)cc1 218136029 MLLWTODQCQDGRB-UHFFFAOYSA-N 296.436 3.023 70 20 CGID CC(C)C[C@H](CO)NC(=O)c1ccc(SC(C)C)cc1 161250459 JKMMGUHOKBJWOM-CQSZACIVSA-N 295.448 3.324 70 20 CGID COc1ccc(OC(C)C)c(NC(=O)NOCC(C)C)c1 160132969 NNZJKPNXAQIPKI-UHFFFAOYSA-N 296.367 3.192 70 20 CGID Cc1cncc(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160628419 FTQMPYXQANBCQA-CABCVRRESA-N 269.348 3.117 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](C)c2ccco2)c1 160628658 UDIBBVNYYLOVEZ-ZDUSSCGKSA-N 286.375 3.270 70 20 CGID Cc1ccc(CCCCC(=O)N[C@H](CCO)C(C)C)cc1 160717537 MQFNRTHZNMJJOT-QGZVFWFLSA-N 291.435 3.231 70 20 CGID COc1cccc(OCCCN[C@@H](C)c2cccnc2)c1 160993382 BMVGFSJLSGIIMI-AWEZNQCLSA-N 286.375 3.210 70 20 CGID C[C@H](OC1CCCCCC1)C(=O)Nc1ccncc1 159604563 QNOXBRLDGCPHCM-LBPRGKRZSA-N 262.353 3.148 70 20 CGID CCO[C@@H](C)C(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 159815724 MWERCXUOTZSNHT-YOEHRIQHSA-N 298.386 3.021 70 20 CGID COc1ccc(N(C)C(=O)CC2CCCC2)cc1F 159395530 GCCHFCOKAQQMPM-UHFFFAOYSA-N 265.328 3.377 70 20 CGID COc1cc(NCc2cccc3c2OCO3)ccc1F 159990378 MHLVDUJEHURTQR-UHFFFAOYSA-N 275.279 3.175 70 20 CGID CCn1cc([C@H](C)Nc2ccc(F)c(OC)c2)cn1 160044873 DLMRXWABRJJXKD-JTQLQIEISA-N 263.316 3.224 70 20 CGID Cc1cccc(C(=O)N2CC=C(C(F)(F)F)CC2)c1O 160601506 MBMWNWHGPNDCJB-UHFFFAOYSA-N 285.265 3.035 70 20 CGID COc1ccc(O)c(C(=O)N[C@H](c2ccccc2)C2CC2)c1 217566895 BAQXLBDKRCMBEQ-QGZVFWFLSA-N 297.354 3.282 70 20 CGID CC(C)c1cc(-c2ccc(S(=O)(=O)Cl)cc2)on1 536952917 FKIRCJSDGPWJHD-UHFFFAOYSA-N 285.752 3.393 70 20 CGID O=S(=O)(Cl)C1=Cc2c(Cl)ccc(Cl)c2OC1 100645360 OIYIKKANZNALFA-UHFFFAOYSA-N 299.562 3.295 70 20 CGID CCN(C)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1 161026554 QMFXIQNXEKOHAB-UHFFFAOYSA-N 298.390 3.308 70 20 CGID Cc1cc(C)cc(OCCN[C@@H](C)C2CCN(C)CC2)c1 161255793 DTXXRAISRPWMFE-INIZCTEOSA-N 290.451 3.002 70 20 CGID CC[C@@H](C)[C@@H](C(=O)N1CCC(C)(O)CC1)c1ccccc1 161304991 BQCXNROEXQDWES-GDBMZVCRSA-N 289.419 3.190 70 20 CGID CC1(NC(=O)N[C@@H](Cc2ccccc2)C2CC2)CCC1 161393442 VNPWBWSXIFUGLC-HNNXBMFYSA-N 272.392 3.250 70 20 CGID C[C@@H](NCCN(C)Cc1ccc(F)cc1)c1cncs1 160119459 TUCMGRHCYHPCGQ-GFCCVEGCSA-N 293.411 3.065 70 20 CGID CC(C)c1ccc(OCCN[C@H](C)c2cnn(C)c2)cc1 160333764 BPBCIGVYODKEDP-CQSZACIVSA-N 287.407 3.273 70 20 CGID CCc1cccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1 160914299 UARZSZQFWDODPX-CQSZACIVSA-N 276.380 3.328 70 20 CGID C[C@H](CCn1cccn1)Nc1ccc2ncsc2c1 159419965 KIBVRBXHOMUSEG-LLVKDONJSA-N 272.377 3.384 70 20 CGID COCc1ccc(CN(C)Cc2ccc(OC)cc2)cc1 159857135 VFTZVMOIFGYKEK-UHFFFAOYSA-N 285.387 3.474 70 20 CGID CC[C@H]1CCCCN1C[C@@H](O)c1cc(OC)ccc1OC 216903180 HXVZGHJIXWCOBA-XJKSGUPXSA-N 293.407 3.002 70 20 CGID CC(C)[C@@H](NC1CCN(C2CCCC2)CC1)C1CC1 160506925 BNBDUJJZRZXFCM-QGZVFWFLSA-N 264.457 3.418 70 20 CGID C1CCN(CCCN2CCC[C@H]2C2CCC2)CC1 160886533 PLYKFVNOZOYHIY-INIZCTEOSA-N 250.430 3.127 70 20 CGID c1ccc2c(NCc3nnc4n3CCCC4)cccc2c1 217317390 ZSCDKDFXLZIIBP-UHFFFAOYSA-N 278.359 3.380 70 20 CGID COc1ccc(O)c(C(=O)N[C@@H](c2ccccc2)C2CC2)c1 217566834 BAQXLBDKRCMBEQ-KRWDZBQOSA-N 297.354 3.282 70 20 CGID CCOc1ccc(CNC(=O)Nc2ccc(C)cn2)cc1 217301077 ACZFZEVEXFMYQN-UHFFFAOYSA-N 285.347 3.110 70 20 CGID CCC(CC)[C@@H](O)CNCc1cccc2c1OC(C)(C)C2 217804273 WPAFGOFSVSNEIP-INIZCTEOSA-N 291.435 3.287 70 20 CGID C[C@@H](CNCc1cccc2cc[nH]c12)N1CCCCC1 218123420 ARWBGQRPEOQTLC-AWEZNQCLSA-N 271.408 3.132 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCc1cccc(C(=O)N(C)C)c1 161410164 GPWUUNNEPQUKNL-WBVHZDCISA-N 288.435 3.447 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@@H]1CCCC[C@H]1C 160006696 JYTZIBQJUIKVRS-CJNGLKHVSA-N 289.423 3.058 70 20 CGID CSC[C@H](CCO)N[C@H](C)C(C)(C)c1ccccc1 160172814 QBJHUOFIIGXGAC-HIFRSBDPSA-N 281.465 3.056 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc2c(c1)NC(=O)CS2 160183965 OMEOLZUGFIQAIK-BMIGLBTASA-N 290.388 3.106 70 20 CGID CCCC1(CNC(=O)NCc2ccc(C)nc2)CCC1 160459457 BTJNXAXIOURUJB-UHFFFAOYSA-N 275.396 3.160 70 20 CGID CN[C@H]1CCN(C(=O)C[C@H](C)c2ccc(C(C)C)cc2)C1 160537880 YSJMTDDVYQKWHO-YOEHRIQHSA-N 288.435 3.124 70 20 CGID CNCC(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1 160557738 VDDVHBCSDDBUIK-CYBMUJFWSA-N 282.815 3.153 70 20 CGID CS[C@@H](C)CNC(=O)NCC1(Cc2ccccc2)CC1 160830612 WYDUKZJIEZKOOL-ZDUSSCGKSA-N 292.448 3.060 70 20 CGID O=C(Nc1cc(F)ccc1F)N[C@@H]1CCO[C@@H](C2CC2)C1 160990372 LLUQFRKRPVOGOI-BXUZGUMPSA-N 296.317 3.044 70 20 CGID O=C(/C=C/C1CCCCC1)N1CCC(NCC2CC2)CC1 159764257 INWSHULQRYKRLH-CMDGGOBGSA-N 290.451 3.114 70 20 CGID Cn1nccc1COc1ccc(C(=O)c2ccccc2)cc1 161202421 CUQLMLVPSWFNML-UHFFFAOYSA-N 292.338 3.230 70 20 CGID COc1cccc(CN(C)C(=O)c2cccc(C)c2F)c1 161398927 OZVIXVPCCNGZFV-UHFFFAOYSA-N 287.334 3.415 70 20 CGID CC[C@@H](NCCNC(=O)C1CC1)c1cccc(Cl)c1F 161494775 DIWFJEQTKYGVGB-CYBMUJFWSA-N 298.789 3.046 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)NCCCC1CCCCC1 160012225 KUPAZFWGBUELCK-CZUORRHYSA-N 279.424 3.468 70 20 CGID CC(C)c1ccc(C(=O)NCCc2ccccc2F)cn1 160046195 IQBCQVLAOAXQHZ-UHFFFAOYSA-N 286.350 3.317 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H](C)C2CCOCC2)C1(C)C 159807343 JNNRRCRXVFXYGT-CWRNSKLLSA-N 283.456 3.375 70 20 CGID CNC(=O)C1(Cc2cccc(Cl)c2)CCCC1 159820404 PQMWQDGEOXNHEW-UHFFFAOYSA-N 251.757 3.189 70 20 CGID C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)N(C)CC1CCOCC1 159644962 SDUBWJZUIAICLK-ZFWWWQNUSA-N 296.455 3.269 70 20 CGID CC(C)(C)c1nsc(N2CCCC[C@H]2c2ncc[nH]2)n1 159844914 VXRCWWLLKMJHSJ-JTQLQIEISA-N 291.424 3.290 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N1CCN(c2ccccc2C)CC1 159711514 CQUJXUWRXUOVCR-YJBOKZPZSA-N 286.419 3.080 70 20 CGID C[C@H](c1ccco1)N(C)C(=O)c1ccc(CN(C)C)cc1 159910957 XCWABVSSHHXMPO-CYBMUJFWSA-N 286.375 3.174 70 20 CGID COC(=O)c1ccc(CSCCc2ccccn2)s1 159914693 NXFISNNNCVVFSO-UHFFFAOYSA-N 293.413 3.406 70 20 CGID CC[C@@H](C(=O)NC[C@@H]1CCCCO1)c1ccc(F)cc1 159370758 CYYCMNNNIGSFMH-LSDHHAIUSA-N 279.355 3.005 70 20 CGID O[C@H](CNCc1ccc(Cl)cc1F)c1ccccc1 160683018 OWDCYDHEWHUSFI-OAHLLOKOSA-N 279.742 3.302 70 20 CGID CC(C)[C@H](NCC(=O)Nc1ccc(Cl)cc1)C1CC1 161114977 OGOHVKZGAWIZQO-HNNXBMFYSA-N 280.799 3.303 70 20 CGID CC(C)CNCc1ccccc1I 218517892 VYXFOKFRSGBMJC-UHFFFAOYSA-N 289.160 3.037 70 20 CGID N[C@@H](CC(=O)N1CCC[C@H]2CCCC[C@H]21)c1ccccc1 218011667 CLIQTFBCHMYLNE-IXDOHACOSA-N 286.419 3.258 70 20 CGID c1ccc(N2CCC(Nc3nccs3)CC2)cc1 217877643 RMHPWTKVPZMPIQ-UHFFFAOYSA-N 259.378 3.224 70 20 CGID CCCn1nccc1CNc1ccc(NC(=O)CC)cc1 160050044 IVPVFUIQLPDGFO-UHFFFAOYSA-N 286.379 3.254 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cccnc1Cl 160084398 OOJJWFFSVGMKGE-NEPJUHHUSA-N 269.820 3.116 70 20 CGID CC(C)c1ccc(C(=O)NCC2(C3CC3)CC2)cn1 160094091 WOTCTICAKSETGO-UHFFFAOYSA-N 258.365 3.125 70 20 CGID O=C(N[C@H]1CCCc2sccc21)c1cnc2ccccn12 160124953 MTTVZFGYJOMGJA-LBPRGKRZSA-N 297.383 3.203 70 20 CGID C[C@@H](NCCN(C)Cc1ccc(F)cc1)C1(C)CC1 160137173 VORVMHJJAZYWCS-CYBMUJFWSA-N 264.388 3.036 70 20 CGID C[C@@H](Sc1nncc2ccccc12)C(=O)OC(C)(C)C 160225991 KICYVYFZDQVGIL-SNVBAGLBSA-N 290.388 3.452 70 20 CGID CCC[C@H](C)CC(=O)Nc1nnc(-c2ccc(C)o2)[nH]1 160389585 BXFJTSLWQZZBER-VIFPVBQESA-N 276.340 3.138 70 20 CGID CN(C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1)C1CCCCCC1 160630579 PVNLZTVAWMGRBU-GDBMZVCRSA-N 294.439 3.308 70 20 CGID Cc1ccc([S@@](=O)Cc2nccs2)c(C)c1 160632181 IXSZCHXQKOPZKG-MRXNPFEDSA-N 251.376 3.068 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)C1CCCC1 160957607 SWPCRKWFMAUKRT-SNVBAGLBSA-N 265.378 3.016 70 20 CGID COc1ccccc1-c1noc([C@H]2CCC(=O)C[C@@H]2C)n1 160990621 NOWJSKQLILVKET-JQWIXIFHSA-N 286.331 3.218 70 20 CGID O=C(NCCOc1ccccc1Cl)c1ccsc1 159439221 PSZGOBLORGWELW-UHFFFAOYSA-N 281.764 3.210 70 20 CGID CC[C@H](NC(=O)Nc1ccc(C)cc1F)[C@H]1CCCO1 159439691 JRKHHEJDHKZUOF-GXTWGEPZSA-N 280.343 3.213 70 20 CGID Cc1ccccc1[C@H](C)NCCCOC[C@@H]1CCOC1 159668871 JNZRPXWCOAVQNW-HOTGVXAUSA-N 277.408 3.089 70 20 CGID Cc1nc2ccccc2cc1C(=O)NCC1(C2CC2)CC1 159671991 FTRFHBHXVLZJPR-UHFFFAOYSA-N 280.371 3.463 70 20 CGID C[C@H](Cc1ccc(Cl)cc1)C(=O)NCCc1ccco1 159483420 IPMAUJXSCHQZAT-GFCCVEGCSA-N 291.778 3.471 70 20 CGID C[C@H](Cc1cccc(F)c1)C(=O)NCC1(C2CC2)CC1 159960877 QPTZERCAPHRXJI-GFCCVEGCSA-N 275.367 3.311 70 20 CGID Cc1ccc(CN[C@@H]2CCSC2)cc1Br 218118316 QTKVWQMDZLFENA-LLVKDONJSA-N 286.238 3.353 70 20 CGID CCN(Cc1cnn(C)c1)Cc1ccccc1OC(F)F 161123258 ROINGEVQUJWUDO-UHFFFAOYSA-N 295.333 3.044 70 20 CGID N[C@@H]1CCCCCC[C@H]1C(=O)N1CCC2(CCCCC2)C1 161196765 WZRVWNDVFHEKGV-HZPDHXFCSA-N 292.467 3.467 70 20 CGID Cc1ccc(C(=O)N[C@H](C)CC(=O)c2ccc(F)cc2)o1 161213388 BKQJPUAJQVEDFC-SNVBAGLBSA-N 289.306 3.118 70 20 CGID Cc1ccc(CN[C@H](C)c2cnn(C(C)C)c2)cn1 161317995 BZVSFPHFIYNVTR-CYBMUJFWSA-N 258.369 3.018 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@H]2CCC(=O)C[C@H]2C)c1 161459414 MFPHCQAZGMMCIF-ABAIWWIYSA-N 287.359 3.223 70 20 CGID C[C@@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)[C@@H]1C 160001399 DEXUZCPYTMUGJL-ZIAGYGMSSA-N 280.456 3.001 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(SC)cc1)[C@H]1CCCO1 160117350 VWZKCDMMFLLDKS-ZIAGYGMSSA-N 294.420 3.488 70 20 CGID CC(C)OCCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160149073 DGOBBNVMPUGZRO-LBPRGKRZSA-N 291.269 3.043 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)c1ccc(C(C)(C)C)cc1 160328475 ARVHUIBMKYBLJB-GFCCVEGCSA-N 291.391 3.056 70 20 CGID CCCCN(C)C(=O)[C@@H]1C[C@@H]1c1sccc1C 160593144 RVQYIAQYMGXFCF-NWDGAFQWSA-N 251.395 3.419 70 20 CGID CC(C)CN(CC(C)C)C(=O)N[C@H]1CCO[C@@H](C2CC2)C1 160641125 LIPZGHZZIHGFJP-JKSUJKDBSA-N 296.455 3.268 70 20 CGID CC[C@@H](NCCOC[C@H]1CCCO1)c1ccc(F)cc1F 160931456 LOFGHUJZBDEBGO-CZUORRHYSA-N 299.361 3.201 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 160992890 AICQEIXORIHQAR-UXEPBGEESA-N 288.391 3.258 70 20 CGID C[C@@H]1CCCN(C(=O)N[C@@H]2CCCc3cc(N)ccc32)C1 159440199 LDSMYQMFZXJNEJ-MLGOLLRUSA-N 287.407 3.088 70 20 CGID CCC(C)(CC)C(=O)NCC1(C(=O)OC)CCCCC1 159477683 MFILNXTUMUTDTJ-UHFFFAOYSA-N 283.412 3.052 70 20 CGID C[C@H]1CCC[C@H](C(=O)N(Cc2cccnc2)C2CC2)C1 159771941 QQMGSYGGXNEILU-ZFWWWQNUSA-N 272.392 3.399 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2NC(=O)c1ccc(Cl)o1 159366785 BXKWKZAKMUWGIJ-LBPRGKRZSA-N 290.750 3.323 70 20 CGID CN(Cc1ccc2ccccc2c1)[C@@H](CN)C1CC1 159759013 DDINKPDVGBARGP-KRWDZBQOSA-N 254.377 3.009 70 20 CGID CCC(CC)CNC(=O)N1CCCC[C@@H]1c1ncc[nH]1 160553005 HWFSLESEVGCZDB-CYBMUJFWSA-N 278.400 3.083 70 20 CGID CS[C@H]1CCCCN(CCCN2CCCCC2)C1 161445378 LVHDGAZKXHHZLL-HNNXBMFYSA-N 270.486 3.080 70 20 CGID CCN(CC[C@H]1CCCN1C)Cc1ccc(OC)cc1 161423387 KRXVJRMQTAIRQL-MRXNPFEDSA-N 276.424 3.001 70 20 CGID C[C@@H](NCCSC(F)(F)F)c1cscn1 218232165 DFZCWOGSDOLGSU-ZCFIWIBFSA-N 256.318 3.047 70 20 CGID COc1ccc2cc([C@@H](C)S(=O)(=O)Cl)ccc2c1 384088330 SBSMZVFYCKIWJI-SECBINFHSA-N 284.764 3.478 70 20 CGID CCc1cccc(NC(=O)NCCCC(=O)OC(C)C)c1 161049427 WYONMHDNGSTZTQ-UHFFFAOYSA-N 292.379 3.102 70 20 CGID Cc1ccc(CNC(=O)c2cccn2C(C)C)cc1 161062568 TVTDRJXTTKFDCA-UHFFFAOYSA-N 256.349 3.307 70 20 CGID C[C@@H]1Sc2ccccc2N(CCn2cccn2)[C@@H]1C 161184488 GXMKCUGSRNSTQG-OLZOCXBDSA-N 273.405 3.272 70 20 CGID CSc1ccc(NC(=O)Cc2nc(C)sc2C)cn1 161279976 ZZVPFAQLWKKSRF-UHFFFAOYSA-N 293.417 3.058 70 20 CGID C[C@@H](Cc1ccccc1Cl)C(=O)N1CCO[C@@H](C)[C@@H]1C 160042005 JEFPSOPHFUNKII-AVGNSLFASA-N 295.810 3.154 70 20 CGID Fc1ccc2oc(N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)nc2c1 160101417 VDERYIGYLGLVMW-GDLCADMTSA-N 288.322 3.336 70 20 CGID CCC[C@H](C(=O)NCCOc1ccccc1)C(C)C 160322809 FFGLZWHGDBJARA-HNNXBMFYSA-N 263.381 3.254 70 20 CGID CC[C@@H](C)CS(=O)(=O)N1CCC2(CCCC2)CC1 160601139 BTMIPAMCKSLJRZ-CYBMUJFWSA-N 273.442 3.019 70 20 CGID CCOCCC1(C(=O)NCc2ccc(C)cc2)CCC1 160621267 WKGHJBIYOSNMKL-UHFFFAOYSA-N 275.392 3.208 70 20 CGID Cc1cc(C(=O)Nc2ccccc2SC(C)C)[nH]n1 160902528 UEJVTRJXFXFNAU-UHFFFAOYSA-N 275.377 3.471 70 20 CGID Cc1nc2c(s1)[C@@H](N[C@@H]1CCCSC1)CCC2 159619689 PYIPMHCGDRCGQQ-PWSUYJOCSA-N 268.451 3.314 70 20 CGID CCc1ncc(C(=O)N(C)c2ccc(OC)c(F)c2)s1 159838961 SLJMIQSVHAHKCP-UHFFFAOYSA-N 294.351 3.130 70 20 CGID CCc1noc(C)c1CNc1c(F)cccc1F 159361979 JYCAICPWHNPGGX-UHFFFAOYSA-N 252.264 3.436 70 20 CGID COC(=O)c1cc(CN(C(C)C)C2CCCCC2)c[nH]1 159770707 DNNNPWTUIIQPDW-UHFFFAOYSA-N 278.396 3.344 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1ccc(OC)cc1F 159616820 UMDYFKFKSLPBBS-IINYFYTJSA-N 265.328 3.143 70 20 CGID CC[C@@H](CO[C@H](C)CC(C)C)CS(=O)(=O)Cl 114472722 NNUGQIQICIJMON-MNOVXSKESA-N 270.822 3.032 70 20 CGID C[C@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CCCC1 776364024 PQNGDWGRIKGOCJ-JTQLQIEISA-N 299.367 3.110 70 20 CGID O=C(C[C@@H]1C=CCCC1)Nc1ccc(S(=O)(=O)F)cc1 777784034 GEVHZQKPRCCBQM-LLVKDONJSA-N 297.351 3.030 70 20 CGID Cc1ccc(NC(=O)N2C[C@@H](C)CCC[C@H]2C)cn1 161329802 KWFSDTCANCXTGZ-WCQYABFASA-N 261.369 3.432 70 20 CGID CCOc1ccc(NC(=O)N(C)[C@@H]2CCSC2)c(C)c1 161429638 ADFIPIFGALCDJC-GFCCVEGCSA-N 294.420 3.363 70 20 CGID C[C@H](CC(=O)NCCc1cccc(O)c1)c1ccccc1 160163301 BPXMMVHHYVYSPZ-CQSZACIVSA-N 283.371 3.245 70 20 CGID CC[C@@H](NC(=O)c1[nH]c(C)cc1C)c1c(C)noc1C 160211997 PWWXHXIPIFTXLJ-GFCCVEGCSA-N 275.352 3.117 70 20 CGID CC[C@H](NC(=O)CC(C)(C)C)c1c(C)noc1C 160278584 LYYKYQQGWFGCHS-NSHDSACASA-N 252.358 3.295 70 20 CGID Cc1cc(Oc2ccc(NC(=O)CC(F)(F)F)cc2)n[nH]1 160465563 WYRJAZJMTFGSQF-UHFFFAOYSA-N 299.252 3.401 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ncnc2oc(C)c(C)c12 160548115 ZXOKNLJHXXAFDJ-ZUZCIYMTSA-N 273.336 3.214 70 20 CGID CN(CCCCNC(=O)[C@@H]1CC1(C)C)c1ccccc1 160583269 DSBVWPOKJOHGJR-HNNXBMFYSA-N 274.408 3.065 70 20 CGID CC(C)CONC(=O)Nc1ccc(OC2CCC2)c(F)c1 160785928 IDFNQQSKLIHWHV-UHFFFAOYSA-N 296.342 3.466 70 20 CGID C[C@H](CN[C@H](C)C1(C)CC1)N1CCc2ccccc2C1 159829459 JXGOXZHNKCTKGK-HUUCEWRRSA-N 272.436 3.211 70 20 CGID CCc1cccc(NC(=O)N[C@@H](CC)[C@@H]2CCCO2)c1 159459522 ZSIQCQATOCMRPL-GJZGRUSLSA-N 276.380 3.328 70 20 CGID Cc1noc(C)c1[C@H](C)CNC(=O)N[C@@H]1CCCC1(C)C 159462255 YQRBUZWOZKXMJL-ZWNOBZJWSA-N 293.411 3.273 70 20 CGID CCOC(=O)CCc1ccc(NC(=O)N[C@@H](C)CC)cc1 159662906 XVKHFLNXGAVOJW-LBPRGKRZSA-N 292.379 3.102 70 20 CGID CC[C@H]1CN(CCn2ccnc2)CC[C@@H]1c1ccccc1 159865466 FTOOSMOVMIVCDM-WMZOPIPTSA-N 283.419 3.399 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)N1CCC[C@@H]1c1ccccc1 159541693 PWFMAUAAMDKFHD-KBRIMQKVSA-N 285.387 3.355 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)CSCc1ccncc1 159595787 QZVWOMZLYHQWNQ-KBPBESRZSA-N 278.421 3.010 70 20 CGID C[C@@H](SCCN1CCOCC1)c1cc(F)ccc1F 159996445 STYCTOHPSGDPDO-LLVKDONJSA-N 287.375 3.091 70 20 CGID CN(CCNCc1coc2ccccc12)C1CCCC1 159823541 BPCANDQUZULRKM-UHFFFAOYSA-N 272.392 3.397 70 20 CGID CCc1nc(CN[C@@H](C)c2ccc(F)cc2Cl)n[nH]1 160447927 TWFQKJLWJZUFNB-QMMMGPOBSA-N 282.750 3.010 70 20 CGID O[C@@H](CNCc1cc(F)cc(Cl)c1)c1ccccc1 160832291 TYNAXOBDYFBHJQ-HNNXBMFYSA-N 279.742 3.302 70 20 CGID C[C@@H](c1ccc(Br)cc1)S(=O)(=O)Cl 88251077 OJEMMCVJACBAPY-LURJTMIESA-N 283.574 3.079 70 20 CGID C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)C[C@H]1C=CCC1 161244755 LMCLRFMXRUNUAH-STQMWFEESA-N 289.350 3.260 70 20 CGID CC[C@H](SCC(=O)NC1CC1)c1ccc(F)cc1 161342558 HNSGTLCOIMQSNU-ZDUSSCGKSA-N 267.369 3.289 70 20 CGID CC[C@@H]1CCCC[C@H]1NCC(=O)N(C)Cc1ccccc1 161413110 DRJMBMAGCKWTIR-IAGOWNOFSA-N 288.435 3.203 70 20 CGID CC(=O)N1CCC[C@H]1c1c(C)nn(CC(C)C)c1Cl 160321124 XWCOHHLCCUEVIG-LBPRGKRZSA-N 283.803 3.184 70 20 CGID O=C(NCc1ccco1)c1cc(F)c(Cl)cc1F 160434563 OEQYSWDMQVFUOW-UHFFFAOYSA-N 271.650 3.141 70 20 CGID c1ccc([C@H]2C[C@H](Nc3ccccn3)CCO2)cc1 160629600 RWAGVDPTYJPTOJ-HUUCEWRRSA-N 254.333 3.414 70 20 CGID CC(C)C[C@@H](CO)NC(=O)c1ccc(OC(C)(C)C)cc1 160802070 RTKHIUMTWFSBLO-AWEZNQCLSA-N 293.407 3.001 70 20 CGID O=C(NO[C@H]1CCCCO1)Nc1cc(F)ccc1Cl 159452549 IDQJKXDAWKUIKB-NSHDSACASA-N 288.706 3.059 70 20 CGID CCOCCC1(CNC(=O)[C@@H](SCC)C(C)C)CC1 159426597 PQFYPJRZUXRNSY-ZDUSSCGKSA-N 287.469 3.087 70 20 CGID CC[C@@H](NC(=O)c1ccc(F)cc1)c1c(C)noc1C 159942626 GZVCJXFAEBTHEE-CYBMUJFWSA-N 276.311 3.312 70 20 CGID COc1cc(CNc2cccc(Cl)n2)cc2c1OCO2 159910505 ADHRXGDMIJGYPT-UHFFFAOYSA-N 292.722 3.084 70 20 CGID CC(C)CCOCC[C@@H](C)CCS(=O)(=O)Cl 114672121 KXFUFHXZLRSTHX-LLVKDONJSA-N 270.822 3.034 70 20 CGID CCCCCNC(=O)NCc1ccc(OCC)cc1 217300864 YENNQLXEJIXOHV-UHFFFAOYSA-N 264.369 3.075 70 20 CGID CC[C@H](C)NC(=O)NCCCOc1c(C)cccc1C 217298091 JMGOFDYDIHHSEF-AWEZNQCLSA-N 278.396 3.170 70 20 CGID C[C@@H](C(=O)N[C@H]1CCOC2(CCCCC2)C1)C1CC1 161021731 ODMNHTZWNOPZLP-OCCSQVGLSA-N 265.397 3.031 70 20 CGID CCOCCCC(=O)N(C)[C@@H]1CCCC[C@@H]1CC 161298216 KLLQIHKBBOQZAQ-UONOGXRCSA-N 255.402 3.230 70 20 CGID C[C@H](Cc1cccc(Cl)c1)C(=O)NC1(C)CCOCC1 161510922 ALXPMJUORJFHFU-GFCCVEGCSA-N 295.810 3.204 70 20 CGID CC(C)OCCC(=O)N[C@H]1CCCc2sccc21 160107087 NVTGTMQFKCQKEL-LBPRGKRZSA-N 267.394 3.057 70 20 CGID CCN(CC)C(=O)C[C@H](C)N[C@H](C)Cc1ccccc1C 160772349 LAPZIIWLZBZDOU-CVEARBPZSA-N 290.451 3.163 70 20 CGID c1ccn2c(CN3CCC[C@@H]4CCC[C@@H]43)cnc2c1 160789951 DNNSBZOSINGDGH-ZFWWWQNUSA-N 255.365 3.099 70 20 CGID COc1ccc(N(C)C(=O)Cc2cccc(F)c2)cc1F 159400654 CZKQHQQPUPEHLB-UHFFFAOYSA-N 291.297 3.179 70 20 CGID COc1ccc(CNC(=O)c2ccc(C(C)C)nc2)cc1 159496750 LAHZMMKLWPABJJ-UHFFFAOYSA-N 284.359 3.144 70 20 CGID CC(C)CCNC(=O)[C@@H](C)N[C@H](C)c1cccc(F)c1F 159509261 MPRBZGALQJZQAV-VXGBXAGGSA-N 298.377 3.166 70 20 CGID CCCN(Cc1ccccn1)[C@@H](C)C(=O)Nc1ccccc1 159953423 NMSRQTRNNAYLEW-HNNXBMFYSA-N 297.402 3.321 70 20 CGID COCc1nc(C)c(C(=O)NC[C@@H]2CCCC[C@@H]2C)s1 159984780 QRXHYTNQLBBIHP-JQWIXIFHSA-N 296.436 3.154 70 20 CGID C[C@@H](c1ccc(OC(F)(F)F)cc1)S(=O)(=O)Cl 309801395 JXRCAMGFUFZHJA-LURJTMIESA-N 288.674 3.215 70 20 CGID Cc1ccc(C(=O)N(C)CCC2CC2)c(Br)n1 160979433 JCYHINSEFHJOPN-UHFFFAOYSA-N 297.196 3.025 70 20 CGID COc1ccc(C(=O)N2CCC[C@H](CC(C)C)C2)c(O)c1 161192287 FGINJXUDLKRDFB-CYBMUJFWSA-N 291.391 3.299 70 20 CGID Cc1ccc(CNC(=O)COc2ccc3[nH]ccc3c2)cc1 160045275 ZDRMKQZZRAJBCC-UHFFFAOYSA-N 294.354 3.172 70 20 CGID CC1(C)C[C@H](NC/C=C/c2ccc(F)cc2)CCO1 160461056 BKPLAQTXFKUVED-NHZBNJEXSA-N 263.356 3.386 70 20 CGID Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3C3CC3)cc2)n[nH]1 160474299 OCOPQYPGCLTVIJ-HUUCEWRRSA-N 297.358 3.495 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)[C@H]1CC=CCC1 160873665 NOGKDKDSRLIYBO-RYUDHWBXSA-N 277.389 3.182 70 20 CGID Cc1noc(C)c1N(C)C(=O)c1ccc(F)c(Cl)c1 160953655 UOCUTPZDFPIMRH-UHFFFAOYSA-N 282.702 3.361 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(C)n(C(C)(C)C)n1 159811112 WTTMREVVCJEQEC-QWHCGFSZSA-N 277.412 3.255 70 20 CGID C[C@@H](c1ccccn1)N1CCO[C@]2(CCc3ccccc32)C1 159634264 OZSYPNIZIHSBGF-HNAYVOBHSA-N 294.398 3.317 70 20 CGID Cc1ccccc1CNC(=O)N1CC[C@@H](C)[C@H](C)C1 159890520 TXKSLSPVOFRITM-TZMCWYRMSA-N 260.381 3.183 70 20 CGID Cc1nccc(NC(=O)N(C)C[C@@H]2CCCCO2)c1Cl 159707961 YLQPAGVOZIGIBR-NSHDSACASA-N 297.786 3.076 70 20 CGID CCC(CC)CC(=O)N[C@H]1CCOC2(CCCC2)C1 159911776 GJEROXQECUBCEQ-AWEZNQCLSA-N 267.413 3.421 70 20 CGID CC[C@H]1CCN(C(=O)Nc2ccnc(C)c2Cl)C1 159755976 BMQGPZZECFFFMY-JTQLQIEISA-N 267.760 3.307 70 20 CGID Fc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(F)c1 159616334 GZVXXRXIBPUTRW-CFVMTHIKSA-N 279.330 3.012 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cccc(F)c1 161111659 LWCZMMHXEYBBES-KCXAZCMYSA-N 264.388 3.349 70 20 CGID CCC[C@H]1[C@@H](C)CCCN1C(=O)NCC1(CCOC)CC1 161125857 LPJYTAJFIVJLIP-GJZGRUSLSA-N 296.455 3.413 70 20 CGID COc1ccc([C@H](C)N(C)CCCn2ccnc2C)cc1 161353784 YVWQWFGJUXVPGQ-AWEZNQCLSA-N 287.407 3.283 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)N(Cc2ccncc2)C2CC2)C1 161474040 GCJAKUALEDARLH-UKRRQHHQSA-N 272.392 3.399 70 20 CGID CCCN(C)C(=O)c1c(F)cccc1Br 160199361 IBKNBRDIDHAMSL-UHFFFAOYSA-N 274.133 3.070 70 20 CGID Cc1nc(CC(=O)N[C@@H]2CCCc3sccc32)cs1 160049998 NTLKGJCNBPDVGX-GFCCVEGCSA-N 292.429 3.249 70 20 CGID CCCn1nccc1CNc1cc(NC(C)=O)ccc1C 160072410 HMHSLGWVXCNZLB-UHFFFAOYSA-N 286.379 3.172 70 20 CGID CCCCN(C(=O)c1cnc2c(c1)ncn2C)[C@@H](C)CC 160437433 HEQZCTSUCAQFBF-LBPRGKRZSA-N 288.395 3.009 70 20 CGID COCc1ccccc1C(=O)N1CCc2c(F)cccc2C1 160786978 MGEBYCXCZNRCSI-UHFFFAOYSA-N 299.345 3.171 70 20 CGID C[C@@H](CCn1cccn1)Nc1cccc(-c2cnco2)c1 159415072 DCSWPPIUOUAXMZ-ZDUSSCGKSA-N 282.347 3.429 70 20 CGID CC[C@H](C)CS(=O)(=O)N(CC)c1ccc(F)c(F)c1 159861710 JNZNTGYQQBZSQK-JTQLQIEISA-N 291.363 3.167 70 20 CGID CC(C)N(C)CCCNCc1cccc2c1OC(C)(C)C2 217793746 RZUKAZUOMOVBEM-UHFFFAOYSA-N 290.451 3.220 70 20 CGID O=C(CC1=CCCCC1)Nc1ccc(S(=O)(=O)F)cc1 763174874 APJBITRPHZPNPR-UHFFFAOYSA-N 297.351 3.174 70 20 CGID CC(C)c1ccc(OCCCS(=O)(=O)Cl)cc1 100495545 QSOIOYRBVUYLGK-UHFFFAOYSA-N 276.785 3.148 70 20 CGID C[C@@H]1CCC[C@H](C(=O)NC[C@@H]2Cc3ccccc32)C1 161051606 PVXADADOWZVOON-SNPRPXQTSA-N 257.377 3.269 70 20 CGID CCC(O)(CC)CNC(=O)CC[C@@H](C)c1ccccc1 161055342 QOZYDEZYUXOESA-CQSZACIVSA-N 277.408 3.238 70 20 CGID COc1cccc(NC(=O)c2cccc(C)c2F)c1 161386631 BLAKUJDDCWSDHW-UHFFFAOYSA-N 259.280 3.395 70 20 CGID Cc1ccc(NC(=O)N2CCc3ccccc3CC2)cn1 161455654 KEUBYCMISQOTRR-UHFFFAOYSA-N 281.359 3.023 70 20 CGID CCCn1cc(C(=O)N[C@H]2CCCc3sccc32)cn1 160013810 PCSRIINOBXEWPK-ZDUSSCGKSA-N 289.404 3.162 70 20 CGID Cc1cccc(CCNC(=O)Nc2cccnc2Cl)c1 160017242 QVPRWHJOAARTKI-UHFFFAOYSA-N 289.766 3.408 70 20 CGID CC(C)Oc1ccc(CN[C@@H](C)c2ccco2)cn1 160092815 DIVUOFPNUFPDPZ-LBPRGKRZSA-N 260.337 3.313 70 20 CGID CN(C(=O)CCCc1ccccc1)c1ccc2c(c1)OCO2 160468056 YNUVISXWRHIZHG-UHFFFAOYSA-N 297.354 3.401 70 20 CGID CN(Cc1cccn1C)C(=O)CCC1CCCCC1 160595992 JZJQPIGWBHYUAU-UHFFFAOYSA-N 262.397 3.344 70 20 CGID CCC(CC)CNC(=O)N(Cc1cccnc1)C(C)C 160597356 FVNWQZCPCVNUDS-UHFFFAOYSA-N 277.412 3.438 70 20 CGID Cc1cnc(N[C@H]2CCO[C@@H](c3ccccc3)C2)nc1C 160615898 UBUHNBUQMNWYGI-JKSUJKDBSA-N 283.375 3.426 70 20 CGID CCc1ccc(/C=C/C(=O)NC[C@H]2CCO[C@@H]2C(C)C)o1 160793328 VBJDHMSOHINXIA-CDRJOZRASA-N 291.391 3.033 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccc(OC(F)F)cc1 160862679 BMENNNVMGJNFSZ-GWCFXTLKSA-N 299.317 3.034 70 20 CGID COC(=O)c1cc(CN[C@@H]2CCCc3sccc32)c[nH]1 160982805 YDQVOGKBJHTAQK-GFCCVEGCSA-N 290.388 3.030 70 20 CGID COCCOc1ccc(NC(=O)[C@H]2CC2(C)C)c(C)c1 159459016 SZWIDGSQRHILRB-CYBMUJFWSA-N 277.364 3.005 70 20 CGID CC1CCC(=CC(=O)NC[C@@H](O)c2ccsc2)CC1 159668701 QAJBDUAVJMIATJ-SBXXRYSUSA-N 279.405 3.034 70 20 CGID CC1CCN(c2cccc(NC(=O)NC(C)C)c2)CC1 159686542 PIMZAVXQQZTDJN-UHFFFAOYSA-N 275.396 3.453 70 20 CGID CCCC(O)(CCC)CC(=O)N1CCC[C@H]1c1ccc[nH]1 159773653 JOPKFNGGQLWFSF-HNNXBMFYSA-N 292.423 3.400 70 20 CGID CCc1cccc(NC(=O)N(C)CCc2nccs2)c1 159998851 FIMIIRYHGDTIOW-UHFFFAOYSA-N 289.404 3.412 70 20 CGID CSCC[C@@H](C)N(C)C(=O)C[C@H]1CNc2ccccc21 161250680 QMXADYUSXUBEDA-OLZOCXBDSA-N 292.448 3.186 70 20 CGID O=C(NCCc1cccc(F)c1)Nc1cc(Cl)ccn1 217449443 OQGZNZGYGMXTME-UHFFFAOYSA-N 293.729 3.238 70 20 CGID C[C@H]1C[C@@H]1c1ccc(CNCCNC(=O)OC(C)(C)C)o1 218118038 GNIUMPNSCRORRY-AAEUAGOBSA-N 294.395 3.017 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cc(C(C)=O)cn1C 161283404 OQXAJYRUEOFABA-DZGCQCFKSA-N 290.407 3.269 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C[C@H]2C=CCC2)n1 161347912 LMYORMPPSTXBBO-LBPRGKRZSA-N 296.374 3.329 70 20 CGID Cn1ncc2c1CCC[C@@H]2NCC1(c2ccc(F)cc2)CC1 161379802 HRDWAKZYHRLSEB-INIZCTEOSA-N 299.393 3.258 70 20 CGID CCCCNc1ccccc1C(=O)NC[C@H](O)[C@@H](C)CC 160039463 NBQXPFPSFSGGBZ-BBRMVZONSA-N 292.423 3.035 70 20 CGID COc1ccc(N(C)C(=O)CC2CCOCC2)cc1Cl 160225069 VAXCHRUUSBXTDI-UHFFFAOYSA-N 297.782 3.128 70 20 CGID Cn1ccc(-c2nc3cccnc3n2Cc2ccccc2)c1 160279088 DKQAQHMVNHBKHX-UHFFFAOYSA-N 288.354 3.485 70 20 CGID CS[C@H](C)CC(=O)N(C)c1cc(C)ccc1C 160578370 BXSCQYQTCNNVPO-GFCCVEGCSA-N 251.395 3.408 70 20 CGID CN(CCOCc1ccccc1)C(=O)c1ccc(Cl)o1 159430957 LSDSIAXAPPTQSK-UHFFFAOYSA-N 293.750 3.222 70 20 CGID CC(C)[C@@H](Cc1ccc(F)cc1)NCCC(C)(C)O 159623002 WYRDZCYAQQOUSY-OAHLLOKOSA-N 267.388 3.143 70 20 CGID CCCCN1CCC(NCc2cc(F)cc(F)c2)CC1 161242953 AXCZENIYNKDSNR-UHFFFAOYSA-N 282.378 3.319 70 20 CGID CCC(CC)c1cc(C(=O)N(C)Cc2ccccn2)on1 161108985 QRNGQRWKCVWATL-UHFFFAOYSA-N 287.363 3.245 70 20 CGID CO[C@H](C)C(=O)N1CCCC[C@@H]1CCCc1ccccc1 161169402 QIWMFIFNFQNLMK-NVXWUHKLSA-N 289.419 3.425 70 20 CGID CCCC[C@H](CC)CNC(=O)N[C@H]1CC[C@@H](CO)CC1 161470181 LGCMPXUJXUOVSW-KKUMJFAQSA-N 284.444 3.053 70 20 CGID CC[C@H](NC(=O)c1cc(C)ncn1)c1cccc(Cl)c1 161481649 APVFSBYXMUYULU-ZDUSSCGKSA-N 289.766 3.320 70 20 CGID c1ccc2nc(N3CCC[C@@H]3CN3CCCCC3)cnc2c1 160437248 AKGRDDODWUYIGO-OAHLLOKOSA-N 296.418 3.085 70 20 CGID CC(C)(C)c1nc(CCNC(=O)C[C@H]2C=CCC2)cs1 160699363 HMGOPVOORBIWAB-LBPRGKRZSA-N 292.448 3.456 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CC(F)(F)F 160935375 OVNOVYXRQZFLSM-VHSXEESVSA-N 251.292 3.366 70 20 CGID COc1cc(C)ccc1N[C@@H](C)CCn1cccn1 159423092 FXKUFDPSFHUXJG-ZDUSSCGKSA-N 259.353 3.091 70 20 CGID CCc1cccc(NC(=O)N(C)[C@@H]2CCSC2)c1 159458315 MBWVCYCDQYFRBN-CYBMUJFWSA-N 264.394 3.218 70 20 CGID CC[C@@H](NC(=O)Nc1ccc2c(c1)CCC2)[C@H]1CCCO1 159511041 RHPIJJXAHCXAFA-HZPDHXFCSA-N 288.391 3.254 70 20 CGID CCn1cc([C@H](C)NC[C@@H](C)N2CCc3ccccc32)cn1 159924550 PYRBMQQHZQPAJL-CABCVRRESA-N 298.434 3.005 70 20 CGID Cc1ccccc1N(CC(=O)NCC1CCC1)C(C)C 217029649 MHYQQYZPQHWGHG-UHFFFAOYSA-N 274.408 3.126 70 20 CGID CN(Cc1ccccc1Cl)C[C@@H](O)Cc1ccccc1 218686688 RBEPMXOAZMYTBJ-INIZCTEOSA-N 289.806 3.375 70 20 CGID CO[C@@H]1CCCC[C@H]1NCCCN(C)c1ccccc1 217819700 PUVAJJJGWAKZPR-IAGOWNOFSA-N 276.424 3.060 70 20 CGID CC[C@@H](C)NC(=O)C(=O)Nc1ccccc1SC(C)C 161007101 PUPPJDAZTJZPOO-LLVKDONJSA-N 294.420 3.040 70 20 CGID COc1ccc(NC(=O)C2(c3ccccc3)CCC2)cc1N 161112228 VHMCDNZKBVBPLS-UHFFFAOYSA-N 296.370 3.338 70 20 CGID Fc1cc(F)c(-c2nc(C3CCOCC3)no2)cc1F 161348332 USODHSUNGRKQSM-UHFFFAOYSA-N 284.237 3.048 70 20 CGID FCCCSCc1noc(-c2cccs2)n1 161414381 XVGUJYYFFAXCBN-UHFFFAOYSA-N 258.343 3.391 70 20 CGID COc1ccccc1CCC(=O)N1[C@H](C)CC[C@H]1C 161426793 GLPBMQAUIHOESN-CHWSQXEVSA-N 261.365 3.027 70 20 CGID CC(C)c1nccc(N(C)[C@@H](CCO)c2ccccc2)n1 160381688 BRVMONZXDUMUDR-HNNXBMFYSA-N 285.391 3.160 70 20 CGID C[C@@H]1CCC[C@@H](OCCCCCC(=O)N(C)C)C1 160636878 TYAMZSQQPCINNP-ZIAGYGMSSA-N 255.402 3.230 70 20 CGID C[C@@H]1CCCN(C(=O)N[C@H]2CCCC(C)(C)C2)C1 160721001 BQPORXMABPQGTR-OLZOCXBDSA-N 252.402 3.397 70 20 CGID C[C@H](c1ccccc1Cl)N(Cc1nncn1C)C1CC1 160806053 QLTFQWKWEFWCOI-LLVKDONJSA-N 290.798 3.194 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(NC(C)=O)ccc1F 160929347 PXAWMNPGLNRBSR-ABAIWWIYSA-N 278.327 3.159 70 20 CGID CCC(CC)NC(=O)[C@H](C)Nc1ccn(CCC(C)C)n1 159885827 RWZWLBZOYMUQIU-ZDUSSCGKSA-N 294.443 3.034 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)Cc1ccc(OC)cc1OC 159494196 DMAXDIIQHHTEKL-WMLDXEAASA-N 291.391 3.098 70 20 CGID N[C@@H](C(=O)N[C@@H]1CCC[C@H]1c1ccccc1)c1ccccc1 159720322 FZUZTRFPWVVENW-RCCFBDPRSA-N 294.398 3.139 70 20 CGID CC[C@@H]1CN(C(=O)[C@@H](C)Cc2ccccc2F)C[C@H](C)O1 159781273 IYPAMVJAGORJSR-KCQAQPDRSA-N 293.382 3.030 70 20 CGID Cc1cnc(C)c(N[C@@H]2CCCc3cc(N)ccc32)n1 159505350 UQXAVEQQDOZCJD-OAHLLOKOSA-N 268.364 3.165 70 20 CGID CCOC(C)(C)CNc1cc(C)nc(C(C)C)n1 159519875 USLRWANAXPKQCM-UHFFFAOYSA-N 251.374 3.135 70 20 CGID C[C@@H](CO)SCc1ccc(Br)cc1F 160761392 RBXWOTUHLHUHIS-ZETCQYMHSA-N 279.174 3.202 70 20 CGID CC[C@@H](C)OCC(CC)(CC)CS(=O)(=O)Cl 114473783 ZFHXDJHUSANBPM-SNVBAGLBSA-N 270.822 3.177 70 20 CGID CCOC(=O)[C@@H](N[C@@H]1CCC(C)(C)C1)c1ccccc1 218749711 BVAUUQGYHPHTNH-CABCVRRESA-N 275.392 3.459 70 20 CGID CCCCCOc1ccc(CS(=O)(=O)Cl)cc1 309801376 HFTISZQEOMEKFS-UHFFFAOYSA-N 276.785 3.324 70 20 CGID CC(C)c1ccc(C(=O)N[C@@H](C)Cc2ccc(O)cc2)cn1 161029273 FHDMDVUSATYTNR-ZDUSSCGKSA-N 298.386 3.272 70 20 CGID CCCCn1ncc(C(=O)N[C@@H]2CCC[C@@H](C)C2)c1C 161053922 LVGSNYCWXDRBBV-TZMCWYRMSA-N 277.412 3.300 70 20 CGID Cc1cc2cc([C@H](C)NCC(C)(C)O)oc2cc1C 160599399 GWSIENCUJZDHBU-LBPRGKRZSA-N 261.365 3.471 70 20 CGID COc1cccc(NC(=O)c2cccn2C(C)C)c1 160700699 DMHGNSDUCIEASC-UHFFFAOYSA-N 258.321 3.330 70 20 CGID O=C(CCCC1CCCCC1)NOCc1cccnc1 160832255 NUJLQPHWDLOZSA-UHFFFAOYSA-N 276.380 3.380 70 20 CGID O=C([C@H](NC1CC=CC1)c1ccccc1)N1CCCCC1 160894646 WUYNEDKRCWHQFA-QGZVFWFLSA-N 284.403 3.048 70 20 CGID CCC(C)(C)NC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 160914069 ROZJKXQXPMACJY-HUUCEWRRSA-N 290.407 3.395 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(NC(C)=O)ccc1F 160929242 PXAWMNPGLNRBSR-IAQYHMDHSA-N 278.327 3.159 70 20 CGID Cc1nccn1-c1ncccc1NC(=O)[C@@H]1CCC[C@@H](C)C1 160982445 FJYTXAINGKFMNF-TZMCWYRMSA-N 298.390 3.341 70 20 CGID CC(C)[C@@H]1CN(C(=O)[C@H]2CCCCO2)c2ccccc2N1 159812492 YTJLLZSOGUVKIE-GOEBONIOSA-N 288.391 3.039 70 20 CGID CN(CCOCc1ccccc1)C(=O)c1ccc(F)cc1 159428700 DSZDSGLOASRTCT-UHFFFAOYSA-N 287.334 3.115 70 20 CGID CCC1(C(=O)N(C)c2ccc(OC)c(F)c2)CCC1 159459806 MCKWRNHYTZPJMK-UHFFFAOYSA-N 265.328 3.377 70 20 CGID CC(C)(C)NC(=O)CN[C@H]1CCC(C)(C)c2ccccc21 159851039 OAPZORJLKJHYKP-HNNXBMFYSA-N 288.435 3.303 70 20 CGID CC[C@@H](NCCc1cc(C)cc(C)c1)[C@H]1CCOC1 159499132 HXAFESIJJNBSKZ-DLBZAZTESA-N 261.409 3.251 70 20 CGID C[C@H]1CC[C@H](C(=O)Nc2cc(C(C)(C)C)ccc2O)O1 159571590 JEUNTWXOUYELGN-IINYFYTJSA-N 277.364 3.196 70 20 CGID Cc1nn(C)c(C)c1[C@H](OC(=O)CC(C)C)C(F)(F)F 159981137 IGHNNWFGGZPXRQ-LBPRGKRZSA-N 292.301 3.230 70 20 CGID Cc1ccccc1OCCCNC(=O)NCc1ccccc1 217300292 GLXDVNKKTFTQSV-UHFFFAOYSA-N 298.386 3.263 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1cc(C)ccc1C 161039441 JBAQSKZNMUWQHE-IBGZPJMESA-N 277.389 3.470 70 20 CGID CCN(Cc1ccccn1)[C@H](C)C(=O)Nc1ccccc1C 161074745 WPDLYYRRKBEOEY-OAHLLOKOSA-N 297.402 3.239 70 20 CGID COc1ccccc1C(=O)N[C@H]1CCc2c(OC)cccc21 160056797 HZVJKZDDMHCUEM-HNNXBMFYSA-N 297.354 3.121 70 20 CGID CC[C@H](C)N(C)CCNC(=O)c1ccc(F)c(SC)c1 160501347 NHUKPIXRPFMSNM-NSHDSACASA-N 298.427 3.008 70 20 CGID C[C@@H](CC(=O)N1CCSc2ncccc21)c1ccncc1 160818823 VOLWANSHUMZJTP-LBPRGKRZSA-N 299.399 3.109 70 20 CGID O=C(NCC(F)(F)F)c1cncc(-c2ccccc2)c1 160896791 VWFWKMSMFNDFGL-UHFFFAOYSA-N 280.249 3.041 70 20 CGID C[C@@H]1CN(C)[C@H](C)C[C@@H]1NC[C@@H]1CCc2ccccc21 160972390 DGQHNIJNJANJDM-DEICHXMPSA-N 272.436 3.035 70 20 CGID O=C(NC[C@@H](c1cccs1)N1CCCC1)C1=CCCC1 159670602 OXAAZOPYAPEFRI-AWEZNQCLSA-N 290.432 3.112 70 20 CGID CC1(C)COCCN1Cc1ncc(-c2ccccc2F)o1 159519753 YORUYZYPTCQASS-UHFFFAOYSA-N 290.338 3.092 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@H]1CCC[C@H](C)C1 159925663 HQBLAKICAUEHJX-ZFWWWQNUSA-N 289.423 3.058 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)CC1CCOCC1 159967000 NVIWESIPDNZIBH-UHFFFAOYSA-N 284.444 3.271 70 20 CGID Cc1ccc(CCCC(=O)Nc2c[nH]c(=O)c(C)c2)s1 159577649 JQYKBQDQGONDBA-UHFFFAOYSA-N 290.388 3.015 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(Cl)cc1F 159990771 SHSBFKGLJYOJOQ-UHFFFAOYSA-N 267.731 3.399 70 20 CGID CC[C@H](N[C@@H](C)Cc1ccccc1C)[C@@H]1CCOC1 160770704 RGAIBWZPPWBVHA-UAGQMJEPSA-N 261.409 3.331 70 20 CGID CC(C)C1CCN(C(=O)[C@@H]2CCCCCC[C@@H]2N)CC1 161269305 QRWVKLUXSQTXCL-CVEARBPZSA-N 280.456 3.179 70 20 CGID COC[C@H](NC(=O)[C@H](C)Cc1cccc(Cl)c1)C1CC1 161284429 DGBJLQJNVGJAHS-ABAIWWIYSA-N 295.810 3.060 70 20 CGID CCCCN(C(=O)[C@H]1CCCNC1)[C@@H](C)c1ccccc1 161356319 OBMJBXNLNYGPIX-RDJZCZTQSA-N 288.435 3.376 70 20 CGID Cc1cc(C(=O)Nc2ccn(CC(F)F)n2)cc(C)c1F 160151821 XOKXYWBVWYFJGY-UHFFFAOYSA-N 297.280 3.156 70 20 CGID Cc1cncc(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160628546 FTQMPYXQANBCQA-GJZGRUSLSA-N 269.348 3.117 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccc(OCC2CC2)cc1 160632064 LWBITJIOPCONSK-UHFFFAOYSA-N 298.386 3.086 70 20 CGID C[C@H](SCCCCS(C)(=O)=O)c1ccccc1 160908719 JNEKOTQGEMKYQV-LBPRGKRZSA-N 272.435 3.306 70 20 CGID Cc1ccc(C)c(-n2ncc(C(=O)NC3CCCC3)c2C)c1 159525242 JMYLOXZPQGFBQQ-UHFFFAOYSA-N 297.402 3.470 70 20 CGID O=C(N[C@@H]1C=CCCC1)N1CCc2cccc(F)c2C1 159938880 YNFFXWVYPQIGGQ-CYBMUJFWSA-N 274.339 3.002 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cc(F)ccc1F 159393583 DTCCYOBXYKTUJQ-GFCCVEGCSA-N 295.329 3.186 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N1C[C@H](c2ccccc2)C[C@H]1C 159789446 WUHDSNIWZKACBM-GARXJVFOSA-N 299.414 3.396 70 20 CGID CC(C)c1ccc(NCc2nnc3n2CCCC3)cc1 217317547 BSGGWGXKDTXGLC-UHFFFAOYSA-N 270.380 3.350 70 20 CGID CS[C@H](C)CNC(=O)Nc1ccccc1OC(C)C 160211964 JCUCZJNYSKUNQB-LLVKDONJSA-N 282.409 3.347 70 20 CGID C[C@H](CC(=O)N(CC(F)(F)F)C1CC1)c1ccncc1 160225892 OQDXVXKISFINPV-SNVBAGLBSA-N 286.297 3.129 70 20 CGID CC1(C)C(Nc2nnc(C(F)(F)F)s2)C1(C)C 160341624 RLSNHBLDSHHNKF-UHFFFAOYSA-N 265.304 3.403 70 20 CGID CC(C)[C@@H]1CCCCN1C(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160385784 NWFXOEBLIQBJEF-PMPSAXMXSA-N 294.439 3.164 70 20 CGID C[C@H]1CN(c2nc(C(F)(F)F)cs2)CC(C)(C)O1 160492328 SLPQWFARZATPGQ-ZETCQYMHSA-N 280.315 3.166 70 20 CGID CC[C@@H](OC1CCCCC1)C(=O)N(C)Cc1cccn1C 160590645 OZAKOUNYSRHZHC-MRXNPFEDSA-N 292.423 3.111 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](C)C2CCOCC2)C1 159457204 VJUIPOWYZPMHNC-AEGPPILISA-N 271.470 3.455 70 20 CGID Cc1cc(N[C@H](C)c2nc(-c3cccs3)no2)nn1C 159666867 DAEKQIXCJHMIAO-SECBINFHSA-N 289.364 3.013 70 20 CGID Cc1ccccc1[C@H](NC(=O)[C@@H](C)N)[C@@H]1CCC[C@H](C)C1 159687622 FOTRFUYDDSBBKO-DPAVQSFQSA-N 288.435 3.326 70 20 CGID CCC(=O)Nc1ccc(NC(=O)C[C@H](C)SC)cc1 159891325 YLVYFCOXUKJXQL-JTQLQIEISA-N 280.393 3.115 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)NCc1ccc2ccccc2c1 159781233 CFYBLFPHSKYWPK-SCLBCKFNSA-N 295.382 3.461 70 20 CGID CCN1CCC(CNCc2ccc(Cl)cc2F)CC1 160801078 PILDGWVESFHVKT-UHFFFAOYSA-N 284.806 3.301 70 20 CGID CCC(CC)(CNC(=O)N1CCC[C@@H](C)C1)SC 218003853 XWYXYSGXKBHQJV-GFCCVEGCSA-N 272.458 3.350 70 20 CGID Cc1ccc(C)c(OCCCCS(=O)(=O)Cl)c1 100495536 HQZQJPQGIOTJSQ-UHFFFAOYSA-N 276.785 3.031 70 20 CGID CC[C@H](C)NC(=O)c1cccc(CN[C@@H](CC)C2CC2)c1 161136447 VILGSRIAANAANN-GUYCJALGSA-N 288.435 3.493 70 20 CGID CC[C@H](SC)c1nc(COc2ccccc2)no1 161243257 JMCZFDREFBJACD-NSHDSACASA-N 264.350 3.463 70 20 CGID Cc1cccc(C)c1CS[C@@H](C)C(=O)NC1CC1 161379410 GHYXSNHKZNOIRI-LBPRGKRZSA-N 263.406 3.204 70 20 CGID CC(C)(C)CN(CCCO)c1nc(C(C)(C)C)ns1 160050640 XGHFLHVGVUTCED-UHFFFAOYSA-N 285.457 3.071 70 20 CGID C[C@@H](CO)N(C)C(=O)CC(c1ccccc1)c1ccccc1 160506812 KCRRGUGORGEILG-HNNXBMFYSA-N 297.398 3.048 70 20 CGID CCCC1(CNC(=O)c2cc(C)n(CC)c2C)CC1 160712443 KHXRDZKMZNCABX-UHFFFAOYSA-N 262.397 3.435 70 20 CGID Cc1ccc([C@H](C)NCC[S@](=O)c2ccccc2)cc1 160789736 GMLBGOZYYAODNF-MGPUTAFESA-N 287.428 3.453 70 20 CGID CSc1cc(C(=O)N[C@H](C)C[C@H]2CCCO2)ccc1F 160837780 IUBRBOZNPWHXSB-ZYHUDNBSSA-N 297.395 3.235 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)cc1C 160936145 ZLXCXHJSLOXBJG-HOTGVXAUSA-N 288.391 3.383 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)NCC1(c2ccccc2)CCC1 159412799 RIMQZTPMUWPELB-WMLDXEAASA-N 299.414 3.230 70 20 CGID CC(C)(NC(=O)c1cccc2[nH]cnc12)c1cccc(F)c1 159614254 LYPNHESQBGSORO-UHFFFAOYSA-N 297.333 3.367 70 20 CGID C[C@@H](SCCN1CCOCC1)c1ncc(C(C)(C)C)o1 159848488 YHJQJLVLDULOAG-GFCCVEGCSA-N 298.452 3.099 70 20 CGID CC(C)Cc1nnc(NC(=O)N[C@H](C)C2CCC2)s1 159498448 VYZQYCDLIYFQLZ-SECBINFHSA-N 282.413 3.047 70 20 CGID CCOC(=O)CN(C)[C@H](C)c1ccc(F)c(Cl)c1 159516743 LXLTUNPCAZXOKP-SECBINFHSA-N 273.735 3.035 70 20 CGID Cn1c(SCC(=O)CCC2CCCC2)nnc1C1CC1 159942716 TZPUGNZEZXBRQY-UHFFFAOYSA-N 293.436 3.324 70 20 CGID C[C@@H](c1cc(F)ccc1F)N(C)CCOCC1CC1 159364060 MMUSLNBNTIUITE-NSHDSACASA-N 269.335 3.384 70 20 CGID C[C@H](NCC1(CO)CCCC1)c1cnc2ccsc2c1 160078484 PGWUTIAHLNIPCC-LBPRGKRZSA-N 290.432 3.500 70 20 CGID COc1ccc(CNC(=O)N2c3ccccc3C[C@@H]2C)cc1 217271358 MJAZBQSCQDKAMT-ZDUSSCGKSA-N 296.370 3.356 70 20 CGID FC(F)Oc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)cc1 217643379 XOZASSFMMFUZNR-CABCVRRESA-N 296.361 3.004 70 20 CGID COc1cc(NC(=O)N2[C@H]3C=CC[C@H]2CC3)cc(OC)c1 218753870 IKQXFJRWQBQXPF-STQMWFEESA-N 288.347 3.029 70 20 CGID CC(C)=CCOC(=O)C(C)(C)Oc1ccc(F)cc1 217399093 FXYKUNMDTKPACT-UHFFFAOYSA-N 266.312 3.493 70 20 CGID CN(C[C@@H](O)Cc1ccccc1)C1CCCCCC1 218770609 SXRKMLLXHLWLBV-KRWDZBQOSA-N 261.409 3.245 70 20 CGID CCC[C@H](C)C(=O)Nc1ccccc1-c1nc(CC)n[nH]1 161067686 AUNGCBJOQVQFFG-NSHDSACASA-N 286.379 3.409 70 20 CGID COc1ccc(NC(=O)C(C)(C)Cc2ccccc2)cc1N 161138147 LCLBIJGXZJYOSU-UHFFFAOYSA-N 298.386 3.485 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)CCCOc1ccc(F)cc1 161439985 NFFATXYUWZSZAT-STQMWFEESA-N 279.355 3.384 70 20 CGID Cc1ccc(Cc2nc(C(=O)NC3CC=CC3)cs2)cc1 160022212 JBKZRGQMRLUELP-UHFFFAOYSA-N 298.411 3.491 70 20 CGID CS[C@H](C)CC(=O)N[C@H]1CCCc2sccc21 160201524 JJJPNBOEWVRGQI-KOLCDFICSA-N 269.435 3.383 70 20 CGID Cc1[nH]c2ccc(Cl)cc2c1C(=O)NCC(F)F 159418006 TWDBKSARRQFKEF-UHFFFAOYSA-N 272.682 3.125 70 20 CGID CCCN(Cc1ccccc1)C(=O)[C@@H]1CCC(=O)C[C@H]1C 159618830 OKKSIFOISPTULL-RHSMWYFYSA-N 287.403 3.431 70 20 CGID Cc1ccccc1[C@@H](NC(=O)[C@H](C)N)C1CCC(C)CC1 159685833 QGYNQURWIBDXHI-RZUWBANKSA-N 288.435 3.326 70 20 CGID CCOc1ccc([C@@H](C)N[C@H](CC)COC)cc1OC 159975341 HZEZJPUVOLJNFB-TZMCWYRMSA-N 281.396 3.170 70 20 CGID Cc1ccc(C(=O)N2CCS[C@H]3CCCC[C@@H]32)cc1N 161430603 HVAJYLVPTWRXMR-GJZGRUSLSA-N 290.432 3.077 70 20 CGID COCCN(Cc1ccccc1)Cc1cccnc1C 160452028 IWTARTLGCSWFDL-UHFFFAOYSA-N 270.376 3.039 70 20 CGID C[C@@H]1CCCN(C(=O)N(C)c2ccc(F)cc2)C1 160481510 TXKFDHXSIXTYLW-LLVKDONJSA-N 250.317 3.114 70 20 CGID CCn1ccnc1CN(Cc1cccs1)C1CC1 160758397 MGMSGEWGOHLCKY-UHFFFAOYSA-N 261.394 3.129 70 20 CGID CCCn1c(C)nnc1COc1ccc(Cl)cc1 161183151 DVTONXOOAKAKGH-UHFFFAOYSA-N 265.744 3.229 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H](C)c1cccs1 161170501 WGUMFTYVFWNSOQ-QWHCGFSZSA-N 252.427 3.273 70 20 CGID CCC(CC)(CN)C(=O)N[C@H]1CCC[C@@H](C(C)C)C1 161213887 ZGTPINZJQOUBGT-KGLIPLIRSA-N 268.445 3.083 70 20 CGID Cc1ccc(NC(=O)N[C@@H](C)c2nc3ccccc3[nH]2)cn1 161380701 KOWWFUKTUQYRLL-NSHDSACASA-N 295.346 3.149 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccccc1N1CCCC1=O 160185953 QUTYRMJMMSAZPC-SJKOYZFVSA-N 286.375 3.188 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)c1cc2c(s1)CCCC2 160240722 WIHWFTPNBXUXLD-WCQYABFASA-N 299.505 3.392 70 20 CGID CSC[C@H](CCO)N[C@H](C)c1ccc2c(c1)CCCC2 160367242 LVKNOJHVTZAOLE-DYVFJYSZSA-N 293.476 3.330 70 20 CGID CC(C)(O)CN[C@@H]1CCSc2c(Cl)cccc21 160647670 GQQOTQRYYRJUCI-LLVKDONJSA-N 271.813 3.237 70 20 CGID COc1cc(C)c([C@H](C)NCCOCC(C)C)cc1OC 160665314 JSSGQSDSVZIATQ-AWEZNQCLSA-N 295.423 3.335 70 20 CGID CCc1nsc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160679589 CIOAMJANJBGFFQ-CHWSQXEVSA-N 289.404 3.433 70 20 CGID CCCC(C)(C)NC(=O)Nc1ccn(CC(F)(F)F)n1 160699913 QDTMRKWCKKLPLK-UHFFFAOYSA-N 292.305 3.146 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(OC)cc1C 159589033 OMHPYQBLVNJJEY-IUODEOHRSA-N 261.365 3.312 70 20 CGID Cc1n[nH]c(C)c1[C@@H](C)CC(=O)N(CC1CC1)CC1CC1 159990983 MECQOSRXCRAHIK-NSHDSACASA-N 289.423 3.169 70 20 CGID Cc1ccc(CNc2cccc(-n3cccn3)c2)cn1 159566126 XDQLNPWLMXMJBQ-UHFFFAOYSA-N 264.332 3.188 70 20 CGID Cc1ccccc1OCCCNC(=O)N1CCCCCC1 217300369 JJLCAYGRYIQCLM-UHFFFAOYSA-N 290.407 3.350 70 20 CGID CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239064 UULCNNAGSCGARF-ZWNOBZJWSA-N 299.367 3.110 70 20 CGID COc1ccc(NC(=O)CCc2ccc(C)cc2C)cc1N 161047646 ULDWABZFDOXJPH-UHFFFAOYSA-N 298.386 3.466 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccc(Cl)s1 161201098 MXAUGWIKYPLPIW-IUCAKERBSA-N 273.785 3.148 70 20 CGID CCC[C@H]1CCCN(Cc2nnc(C)n2CCC)C1 161222770 GVHPTRHNZVHFFQ-AWEZNQCLSA-N 264.417 3.009 70 20 CGID CC[C@@H](C)c1cc(C(=O)N(Cc2ccncc2)C2CC2)on1 161476147 PEPZFFCAKSMWQI-GFCCVEGCSA-N 299.374 3.388 70 20 CGID CCN(CC)C(=O)c1c(F)cccc1Br 160197922 ARWRBSDYVUFXCC-UHFFFAOYSA-N 274.133 3.070 70 20 CGID CCc1ccc([C@H](CC)N[C@@H](CCO)CSC)cc1 160258552 GNGRHKIVAAAPLY-HOTGVXAUSA-N 281.465 3.404 70 20 CGID CC[C@H](NC(=O)CC1CCC1)c1c(C)noc1C 160264150 RUUMRKLYDACEOU-LBPRGKRZSA-N 250.342 3.049 70 20 CGID CC[C@H](CN[C@@H](C)c1cnccn1)Oc1ccccc1F 160315952 VRFRAQIAKUBHER-QWHCGFSZSA-N 289.354 3.124 70 20 CGID CCC[C@@H](N)C(=O)N[C@@H](c1ccccc1Cl)C(C)C 160830153 JVBCHCFQKXSEEA-ZIAGYGMSSA-N 282.815 3.281 70 20 CGID CCOc1ccccc1N(C)Cc1nc(-c2ccco2)no1 159393312 CGGWQGWPWFSNIZ-UHFFFAOYSA-N 299.330 3.365 70 20 CGID CC[C@@H](C)[C@@H](NCc1cc(F)cc(Cl)c1)C(=O)OC 160873500 CPGAZCDVDHRYEC-NOZJJQNGSA-N 287.762 3.156 70 20 CGID Cc1cccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)n1 160342888 ITPDJKFZOMOXTI-UHFFFAOYSA-N 283.306 3.192 70 20 CGID CCCc1cc(C(=O)Nc2cccc(C(=O)CC)c2)[nH]n1 160726560 YRWUHEFYCHLQKH-UHFFFAOYSA-N 285.347 3.207 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCCC[C@@H]1C 160933892 KOBLRMJGYSNYMM-LBPRGKRZSA-N 263.385 3.259 70 20 CGID C[C@@H](CN[C@H](C)c1ccco1)N1CCc2ccccc2C1 159820184 HOOMTGWQLFIGGG-LSDHHAIUSA-N 284.403 3.377 70 20 CGID CC[C@@H](C)OCC(=O)N1CCC[C@@H]1C1CCCCC1 159450941 VOIZVERIBQZIOK-UKRRQHHQSA-N 267.413 3.373 70 20 CGID CC[C@@H](NC(=O)Nc1cc(C)ccc1F)[C@@H]1CCCO1 159478043 QPZVCJXQKGTGCX-OCCSQVGLSA-N 280.343 3.213 70 20 CGID CCCCO[C@@H]1C[C@@H](N[C@@H](CC)c2cnn(C)c2)C1(C)C 159767219 HODKWEBKEJUXJY-ARFHVFGLSA-N 293.455 3.445 70 20 CGID C[C@H](NC1CCN(C2CCCC2)CC1)C1(C)CC1 160498802 BLZSUZAIAFJVRU-ZDUSSCGKSA-N 250.430 3.172 70 20 CGID COc1ccc(CNc2ccnc(C)c2)cc1OC 160912599 MOPBKIAHXSTPKE-UHFFFAOYSA-N 258.321 3.019 70 20 CGID C[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)C1 218630582 PEZRJATXXMRQAX-ZYHUDNBSSA-N 287.812 3.197 70 20 CGID O=S(=O)(Cl)C[C@H](F)c1cccc(C(F)(F)F)c1 1537958782 KIAJEJVSYJPYPF-QMMMGPOBSA-N 290.665 3.285 70 20 CGID COc1cc(NCC(=O)Nc2ccc(C)cc2)ccc1F 160283261 LQRSLQYWFBCHRG-UHFFFAOYSA-N 288.322 3.193 70 20 CGID C[C@H]1C[C@@H]1c1cc(NC(=O)CC2CCSCC2)[nH]n1 160317577 HLQKVCJCKMSZRA-ONGXEEELSA-N 279.409 3.005 70 20 CGID CC(C)[C@H](CCO)NC(=O)C[C@H](C)C1CCCCC1 160760402 LUAWXOXZKIYPIU-ZFWWWQNUSA-N 269.429 3.116 70 20 CGID CN(Cc1cc(C(N)=O)cs1)Cc1ccccc1Cl 160824352 OZDIUHISFLXEIJ-UHFFFAOYSA-N 294.807 3.132 70 20 CGID C[C@@H](NCc1ccc(CN(C)C)cc1)c1cncc(F)c1 160886797 PVBCJWDOPIDPOT-CYBMUJFWSA-N 287.382 3.133 70 20 CGID CC[C@H](Nc1ccc(-c2csc(C)n2)cc1)C(=O)OC 159484858 APAKIFJKVXZFAB-ZDUSSCGKSA-N 290.388 3.482 70 20 CGID CCS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)CC2CC2)cc1 159503219 VCYQTRXNBNGRJE-QWHCGFSZSA-N 295.448 3.319 70 20 CGID O=C(CC1CC1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159383129 BFWOPOSHHRMXAZ-HOCLYGCPSA-N 273.376 3.071 70 20 CGID COc1cc(CNCc2ccc(Cl)cc2F)ccn1 160820132 UOOBSZMVCNBNKG-UHFFFAOYSA-N 280.730 3.173 70 20 CGID CC1=C(C(=O)N2CCC[C@@H]2c2ccccc2)CCCO1 161270959 MBVBFEFCOMKFDZ-MRXNPFEDSA-N 271.360 3.435 70 20 CGID COC[C@@H](N[C@H]1CCOc2c(Cl)cccc21)C1CC1 161293419 YIKFNCQHBLIJKL-UONOGXRCSA-N 281.783 3.178 70 20 CGID COc1ccc(NC(=O)C2(Cc3ccccc3)CC2)cc1N 161296177 KRWCLFKZUCZOBD-UHFFFAOYSA-N 296.370 3.239 70 20 CGID CC(C)OCCC(=O)O[C@H](c1ccccn1)C(F)(F)F 160149204 DGOBBNVMPUGZRO-GFCCVEGCSA-N 291.269 3.043 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)CC[C@@H](C)OC 160166908 REMODIMZZPKLOI-OLZOCXBDSA-N 280.364 3.423 70 20 CGID CCOCCC1(CNC(=O)N[C@@H]2CCC[C@H]2CC)CC1 160230549 RPQAFKJBGQGAKF-ZIAGYGMSSA-N 282.428 3.071 70 20 CGID Brc1cncc(N[C@H]2CCO[C@H](C3CC3)C2)c1 160348879 TUDQMDLIDNLNEV-AAEUAGOBSA-N 297.196 3.214 70 20 CGID O=C(NCc1nc(C2CC2)cs1)NCC1(C2CC2)CC1 160638563 XMXDFXGWLDOHHU-UHFFFAOYSA-N 291.420 3.010 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N1CCN(c2ccccc2C)CC1 159711171 CQUJXUWRXUOVCR-CRAIPNDOSA-N 286.419 3.080 70 20 CGID CCC(CC)S[C@H]1CCCN(CC(F)(F)F)C1=O 159718648 GAYUCLBQUZMGFF-JTQLQIEISA-N 283.359 3.462 70 20 CGID CC[C@H](C)OCC(=O)Nc1ccc(OC(F)F)c(F)c1 159380669 GKYWIKIVVXQWTE-QMMMGPOBSA-N 291.269 3.181 70 20 CGID CN(Cc1ccc(C(F)(F)F)cc1)C[C@@H]1CCC[C@@H]1O 159662721 MYXOBCSGNRSRLO-JSGCOSHPSA-N 287.325 3.298 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1ccccc1OC 160086523 ZJWNAUMLVQAIBJ-KBPBESRZSA-N 264.413 3.076 70 20 CGID COc1cccc(CN(C)C(=O)N2CCCCCC2)c1 160388289 OMILJAVUANVXFA-UHFFFAOYSA-N 276.380 3.123 70 20 CGID CCCN(Cc1ccccc1)Cc1ccc(CO)o1 160478303 FWNJYSIOMVKPHI-UHFFFAOYSA-N 259.349 3.184 70 20 CGID CC[C@H](Nc1ccn(C)n1)c1ccc(F)cc1F 160699338 FUHAANZYCAKXQP-LBPRGKRZSA-N 251.280 3.262 70 20 CGID COc1ccc(NC(=O)C2(CC(C)C)CCC2)cc1N 161087030 DRODHHPJTFTCGC-UHFFFAOYSA-N 276.380 3.432 70 20 CGID COc1ccc(NC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)cc1N 161048676 QEYVMOWZRQAVDD-DOMZBBRYSA-N 288.391 3.454 70 20 CGID Cn1ncc2c1CCC[C@H]2NCc1coc2ccccc12 161081719 HJYPRNBVNGHDQT-OAHLLOKOSA-N 281.359 3.334 70 20 CGID CCC[C@@H](N[C@H](CCO)CSC)c1ccccc1 160148613 RYUSPLYNNVEROO-HUUCEWRRSA-N 267.438 3.231 70 20 CGID CCCCCc1nnc(NC(=O)CO[C@H](C)CC)s1 160352916 AONMVFMKLQYCCH-SNVBAGLBSA-N 285.413 3.024 70 20 CGID CC(C)(C)OC(=O)Nc1ccccc1C(=O)NCC1CC1 160464743 ROVJIJQRNRUSOX-UHFFFAOYSA-N 290.363 3.173 70 20 CGID Cc1cccc([C@@H]2CCCN2C(=O)[C@H]2CC[C@H](N)C2)c1C 160721155 ZKQASOMWHLUKJW-ZOBUZTSGSA-N 286.419 3.094 70 20 CGID CC(C)NC(=O)CN[C@H](C)c1ccc(SC(C)C)cc1 160966216 OGPJIWBEKNMGJU-CYBMUJFWSA-N 294.464 3.362 70 20 CGID COC(=O)CN(C1CC1)[C@@H](C)c1ccc(Cl)cc1 159487033 RTRJDKZVXXXTOC-JTQLQIEISA-N 267.756 3.038 70 20 CGID C[C@@H](c1cccc(F)c1)N1CCN(Cc2cccnc2)CC1 159483979 JVIFMZAOJBYVMD-HNNXBMFYSA-N 299.393 3.100 70 20 CGID C[C@H](c1c(F)cccc1F)N(C)C[C@@H]1CCC[C@@H]1O 159596369 DAWYCSJAJNBEDU-SUNKGSAMSA-N 269.335 3.119 70 20 CGID C[C@H]1C[C@H](c2ccccc2)C[C@H](NCC(C)(C)O)C1 160659171 OTCWJWWULOBEKU-CWRNSKLLSA-N 261.409 3.319 70 20 CGID CN(Cc1cccc(Cl)c1)Cc1ccc(CO)o1 161131485 WSMRABCYZOMBBX-UHFFFAOYSA-N 265.740 3.057 70 20 CGID Cc1cccc(CCNC(=O)N2C[C@@H](C)C[C@H](C)C2)c1 217404511 GAQADWVMOJHLPS-GJZGRUSLSA-N 274.408 3.225 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)Cc1ccc(O)cc1)C2 216807505 ZVNWUBQCALUTTN-YEWWUXTCSA-N 287.403 3.266 70 20 CGID CC[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccc(F)cc1 217688533 QXHIAKIVLZHVSM-BBWFWOEESA-N 276.399 3.493 70 20 CGID CC[C@@H](c1ccc(F)cc1)N1CCC[C@@H](CNC)C1 218071662 HWKGKIDXXLGJQM-BBRMVZONSA-N 264.388 3.208 70 20 CGID CCC(CC)(CN)C(=O)Nc1ccc(CSC)cc1 161209527 JJPUBHXDKZAYMS-UHFFFAOYSA-N 280.437 3.253 70 20 CGID COc1cc(Cl)ccc1C(=O)N1[C@@H](C)CC[C@H]1C 161389822 UTUXEWRMDJKATN-AOOOYVTPSA-N 267.756 3.362 70 20 CGID CCN(Cc1ccccn1)C(=O)C[C@H](C)c1ccncc1 161395579 BJABVDNOHAQBFD-AWEZNQCLSA-N 283.375 3.019 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1oc(C)cc1C 160068326 JZRAUSAGSPSTLK-AWEZNQCLSA-N 285.343 3.322 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1ccnc(F)c1 160200284 LYKGPHXUWAWGCR-NSHDSACASA-N 289.306 3.456 70 20 CGID CN1c2ccccc2C(=O)N[C@H]1c1coc2ccccc12 160295784 QMAJUNRZWDCAHK-MRXNPFEDSA-N 278.311 3.311 70 20 CGID CS[C@@H](C)CC(=O)N(C)CCCOc1ccccc1C 160566217 DNDPXKJIAGECGN-AWEZNQCLSA-N 295.448 3.364 70 20 CGID O=C(Nc1cccc(OC(F)(F)F)c1)[C@H]1CCCCO1 160702028 ITNHGUMNSRPBDY-LLVKDONJSA-N 289.253 3.093 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CC[C@@H](C)c1ccccc1 160709370 OXWSLMTYWCNLOV-ZBFHGGJFSA-N 277.408 3.094 70 20 CGID CCCCO[C@H](C)C(=O)N[C@H](CC)c1c(C)noc1C 160755607 PCLJUVPPJFQADR-CHWSQXEVSA-N 282.384 3.064 70 20 CGID CCn1nc(C)c(Nc2nc(C(C)(C)C)ns2)c1C 159681175 OPDISTKOYPZYHT-UHFFFAOYSA-N 279.413 3.412 70 20 CGID CO[C@@H](CNC(=O)Nc1ccnc(C)c1Cl)C(C)(C)C 159918968 BEQUEEMEGWRQCH-NSHDSACASA-N 299.802 3.226 70 20 CGID CCCn1nccc1CN[C@@H](C)c1cccc(C)c1 160183822 LUWJHHMTNFLNMM-AWEZNQCLSA-N 257.381 3.452 70 20 CGID Cc1ccc(OCCCNC(=O)N2CCC[C@H](C)C2)cc1 217297869 ZYGHYSCPJJMNCD-HNNXBMFYSA-N 290.407 3.205 70 20 CGID CC(C)CN1CCOc2cc(Br)ccc21 217240219 NETZVQRIGCQCNC-UHFFFAOYSA-N 270.170 3.304 70 20 CGID CC(C)n1nccc1NC(=O)C1C2CC3CC(C2)CC1C3 216672399 JPJRBLBLYKGLDN-UHFFFAOYSA-N 287.407 3.475 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cccc(Oc2cnccn2)c1 161508907 SLQXCNLIFDHDRY-BETUJISGSA-N 297.358 3.282 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1COc2ccccc21 160034981 OLOTZRGMOQNBPT-ZIAGYGMSSA-N 299.395 3.418 70 20 CGID CCC(CC)n1ncc(C(=O)Nc2ccc(F)cn2)c1C 160205010 ATGNDNJCBQQLNU-UHFFFAOYSA-N 290.342 3.339 70 20 CGID CC1(C)CCC(C(=O)Nc2cnn(CC(F)F)c2)CC1 160484889 MJAQZSUVOVWJPE-UHFFFAOYSA-N 285.338 3.303 70 20 CGID CN(Cc1cccn1C)C(=O)C[C@@H]1CCc2ccccc21 160571560 XODYSZSHJPYTJS-HNNXBMFYSA-N 282.387 3.104 70 20 CGID Cc1n[nH]cc1CN(C)Cc1ccc(C(C)C)cc1 160669024 HHEINHMWTAXGRW-UHFFFAOYSA-N 257.381 3.474 70 20 CGID Cc1csc(CCCCN[C@@H](C)C2CCOCC2)n1 160723069 HQHZLRZHOOWRRM-ZDUSSCGKSA-N 282.453 3.179 70 20 CGID CCc1nc(CN[C@H](c2cccc(C)c2)C(F)(F)F)n[nH]1 160731762 WSFVIMABEIBQGQ-CYBMUJFWSA-N 298.312 3.069 70 20 CGID C[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C)C1CC1 159701557 SWEYIFPFEDYNRI-WDEREUQCSA-N 265.784 3.433 70 20 CGID Cc1cc(C(=O)N[C@H]2CCOC3(CCCC3)C2)oc1C 159510136 LTYGLKSSWLQOFO-ZDUSSCGKSA-N 277.364 3.118 70 20 CGID CCCCn1ncc(NC(=O)N2CC[C@H](C)[C@H]2C)c1C 159937505 LTZBMMSSZFBBKX-NWDGAFQWSA-N 278.400 3.254 70 20 CGID CCC[C@@H](C)N(C)c1ccncc1Br 159955069 VNYQOAJCVKPYDK-SECBINFHSA-N 257.175 3.469 70 20 CGID CC(=O)c1cccc(NC(=O)N2CC=C(C)CC2)c1 159968214 SBWBTECJXVDYCO-UHFFFAOYSA-N 258.321 3.073 70 20 CGID C[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1ccc(F)cc1 218434111 MNVRQPGDIMTAMM-XNRPHZJLSA-N 265.372 3.275 70 20 CGID CC(C)(C)OC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1F 217685507 REUSTLMEWGJKRX-CMPLNLGQSA-N 269.291 3.345 70 20 CGID C1CCC(C2CCN(C[C@@H]3CCCNC3)CC2)CC1 217122294 JYCCULCKRHHWDW-OAHLLOKOSA-N 264.457 3.278 70 20 CGID CC1=C(C(=O)N(Cc2ccccc2F)C2CC2)CCCO1 161181616 YZTFUHCHVNWNGG-UHFFFAOYSA-N 289.350 3.401 70 20 CGID Cc1cccc(C)c1CSCC(=O)NCC(C)C 161384412 LWKIOLFDKZPFIA-UHFFFAOYSA-N 265.422 3.309 70 20 CGID CC(C)CCn1ccc(NC(=O)N2Cc3ccccc3C2)n1 161501162 IDCVEDIXGVGVEN-UHFFFAOYSA-N 298.390 3.477 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](CC(C)C)c1ccccn1 160064657 YVKNTNYZBIPXCX-WBVHZDCISA-N 277.456 3.489 70 20 CGID CC[C@@H]1CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1 160079432 NSUPXSRMAMVACT-GFCCVEGCSA-N 288.366 3.498 70 20 CGID CC[C@H](C)N(C)CCCc1nc(-c2ccccc2)no1 160342216 ZLCJJCCPAPGUET-ZDUSSCGKSA-N 273.380 3.400 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCc1ccccc1OC(F)F 160554787 NQCIGIHWBWDDMF-ABAIWWIYSA-N 283.318 3.340 70 20 CGID O=C(NC1CC=CC1)C1(c2ccc(F)cc2)CCC1 160996402 VGSWGUMNRULMBA-UHFFFAOYSA-N 259.324 3.082 70 20 CGID CC[C@H]1CN(C(=O)Nc2ccnc(C)c2Cl)CCS1 159511672 FGKKVLCCKLDJTJ-JTQLQIEISA-N 299.827 3.403 70 20 CGID CC[C@@H](CCO)NC(=O)C1(c2cccc(Cl)c2)CCC1 160088392 GWIBOLHACKVZBK-AWEZNQCLSA-N 295.810 3.039 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cc(F)cc(F)c1 161080063 JITPDQUFQWLWEL-UVBJJODRSA-N 282.378 3.488 70 20 CGID CC(C)(C)CNC[C@@H]1CCCCN1C(=O)OC(C)(C)C 218148326 SABMJDWEGYHLHO-ZDUSSCGKSA-N 284.444 3.412 70 20 CGID O=C(Nc1ccc(F)c(F)c1)N[C@H]1CCO[C@@H](C2CC2)C1 161002770 KPVOFNKQPPVLBL-SMDDNHRTSA-N 296.317 3.044 70 20 CGID COc1cccc(C2(NC(=O)c3cc(C)c(C)o3)CC2)c1 161191251 WVRHVRIYFOXMDJ-UHFFFAOYSA-N 285.343 3.324 70 20 CGID CCCn1c(C)nnc1COc1ccc2c(c1)CCCC2=O 161314619 UOPSZKNSXMWEMI-UHFFFAOYSA-N 299.374 3.095 70 20 CGID Cc1cc2cc(C(=O)N[C@@H]3CCC[C@H](N)C3)oc2cc1C 161447490 ZXNLHVKIXXBZPE-UONOGXRCSA-N 286.375 3.049 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)CCc3ccoc3)c2C)o1 161510712 NFHRMEZRFGFEPJ-UHFFFAOYSA-N 299.330 3.451 70 20 CGID COc1ccc(OC)c([C@@H](C)N[C@H](C)C2CCOCC2)c1 160012134 OQMSDBNEAOQKSZ-CHWSQXEVSA-N 293.407 3.170 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)CC[C@@H]1CCOC1 160121407 LXLHSFKZQOWZIS-UONOGXRCSA-N 292.375 3.425 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)c1cnc2ccccn12 160124826 MTTVZFGYJOMGJA-GFCCVEGCSA-N 297.383 3.203 70 20 CGID CCC[C@H](C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160475827 DJQFEOOUMJQFCC-UONOGXRCSA-N 267.413 3.421 70 20 CGID CCC[C@@H](C)C(=O)N[C@@H](CC)c1c(C)noc1C 160484399 CTEAFERUUTYKOI-SKDRFNHKSA-N 252.358 3.295 70 20 CGID CC1(C)C[C@@H](NCC2=Cc3ccccc3OC2)CCO1 160516518 CYZUZFYQHDSCDC-HNNXBMFYSA-N 273.376 3.010 70 20 CGID COCC(C)(C)C(=O)Nc1ccc(Cl)cc1C 160605961 PEERQKFYXBHZRD-UHFFFAOYSA-N 255.745 3.260 70 20 CGID C[C@H](NCC(C)(C)O)c1cc(Cl)ccc1OC(F)F 160639072 UDMVBRMUXGMREW-QMMMGPOBSA-N 293.741 3.363 70 20 CGID Cc1[nH]ccc1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159455943 KHBXRVWSGAKNGK-YOEHRIQHSA-N 298.386 3.221 70 20 CGID CC(C)c1ccc(C2(CNC(=O)[C@H](C)N)CCCC2)cc1 159473035 UQZZIGVBRFZOBA-AWEZNQCLSA-N 288.435 3.085 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@H](C)C(C)C)n1 159509176 NFFULAZBAQIZQM-GFCCVEGCSA-N 266.389 3.095 70 20 CGID CCC(C)(C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159729822 MYRBMOLWWFNXTH-LBPRGKRZSA-N 253.386 3.031 70 20 CGID CCc1onc(C)c1NC(=O)Nc1cc(C(C)(C)C)on1 159391915 JGNGQMPZAPUVTB-UHFFFAOYSA-N 292.339 3.475 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cccc(Cl)c1 159779975 HQNGGYIZBKLOBC-UHFFFAOYSA-N 284.787 3.260 70 20 CGID CC1(C)CC[C@H](COC(=O)c2cc(N)ccc2Cl)O1 160776886 QNNZBQLXQUMZTN-SNVBAGLBSA-N 283.755 3.037 70 20 CGID Cc1ccc(OCCCNC(=O)N2CCC[C@@H](C)C2)cc1 217297868 ZYGHYSCPJJMNCD-OAHLLOKOSA-N 290.407 3.205 70 20 CGID CC1=CCN(C(=O)c2ccc(Br)cc2)CC1 160178764 RXCDGHJZXBAPJO-UHFFFAOYSA-N 280.165 3.241 70 20 CGID CN(Cc1cccc(F)c1)Cc1ccc2cn[nH]c2c1 160459225 NLQLBVGODXRLSJ-UHFFFAOYSA-N 269.323 3.334 70 20 CGID Cc1ccccc1NC(=O)NCCc1ccc(O)cc1 217310794 XSETZAOAEACWEI-UHFFFAOYSA-N 270.332 3.065 70 20 CGID Cc1cccc(-c2ccc(CNC(=O)[C@@H](N)C(C)C)cc2)c1 161005763 ORCITXNDYIFMKG-SFHVURJKSA-N 296.414 3.262 70 20 CGID CCCCN(C(=O)C1CCNCC1)[C@@H](C)c1ccccc1 161355035 BKSMJMLDVFIYIK-HNNXBMFYSA-N 288.435 3.376 70 20 CGID Cc1ccc(F)c(NC(=O)N(C)CCc2nccs2)c1 160024450 JBPZOIMUEYXEQU-UHFFFAOYSA-N 293.367 3.297 70 20 CGID CCCCCOCC(=O)N[C@@H]1CCCc2sccc21 160289566 PEKXOWBBNFQBRC-CYBMUJFWSA-N 281.421 3.449 70 20 CGID CCC[C@@H](N[C@@H]1CCc2nc(C)nn2C1)c1ccccc1 160296731 VXVWKTKZBDFZRU-HZPDHXFCSA-N 284.407 3.032 70 20 CGID C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C)[C@H](C)C1 160874235 AGRZORREFNATIS-MJBXVCDLSA-N 290.407 3.011 70 20 CGID C[C@@H](CCc1ccco1)NC[C@](C)(O)c1ccsc1 159976543 RNXVBQCPRHBCIN-WFASDCNBSA-N 279.405 3.160 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2CCN(C3CCCC3)C2)n1 159368942 GYGLDMCYLZBXAM-LLVKDONJSA-N 294.468 3.264 70 20 CGID C[C@H](CCC(C)(C)C)NC(=O)c1ccc(CN)cc1 161230140 DNJXFLRFAQHLOB-GFCCVEGCSA-N 262.397 3.090 70 20 CGID C[C@@H]1OCC[C@@H]1Sc1nc(C(C)(C)C)ns1 160099593 PTLSEMRBVUVHKH-YUMQZZPRSA-N 258.412 3.105 70 20 CGID CC[C@@H](C)[C@@H](C)NCc1ccc(OC(C)C)nc1 160039721 GPRJTOSUJBEQEA-CHWSQXEVSA-N 250.386 3.393 70 20 CGID C[C@@H]1CCCC[C@@H]1NC(=O)c1ccnc(Cl)c1F 160881499 YESIMVGPCYTPRH-SCZZXKLOSA-N 270.735 3.183 70 20 CGID CCc1ncnc(NCc2ccc(C)s2)c1F 217977202 WNFIRGXAWJFYKK-UHFFFAOYSA-N 251.330 3.160 70 20 CGID CN(Cc1cccc(Cl)c1)Cc1cc(C(N)=O)cs1 161135356 HIIQRAPXSVHKBG-UHFFFAOYSA-N 294.807 3.132 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@H](C)CC1CCCCC1 161157310 QMONLDUPIZFYCW-HIFRSBDPSA-N 269.429 3.116 70 20 CGID CCCCC(=O)O[C@H](c1ccccn1)C(F)(F)F 160016096 VLMPRIMIDMLPOG-LLVKDONJSA-N 261.243 3.418 70 20 CGID CC(C)Oc1ccc(CN[C@H](C)C(C)(C)C)cn1 160091016 WXEDUNZOJZFPHW-GFCCVEGCSA-N 250.386 3.393 70 20 CGID CC[C@@H](CN[C@H](C)c1cnn(C)c1)Oc1ccccc1F 160317129 GABHVGVUSGSCKU-OCCSQVGLSA-N 291.370 3.067 70 20 CGID C[C@@H](CC(=O)N1c2ccccc2OC[C@@H]1C)c1ccncc1 160906753 PQZUWYSJIFRWFS-KBPBESRZSA-N 296.370 3.389 70 20 CGID Cc1conc1NC(=O)[C@H](OC(C)(C)C)c1ccccc1 160950244 PDRBHKFUCMKRQG-CYBMUJFWSA-N 288.347 3.478 70 20 CGID CCCCn1ncc(NC(=O)N(C)[C@H](C)CC)c1C 159730860 XMZYAPLZRKPIAJ-LLVKDONJSA-N 266.389 3.254 70 20 CGID CN(CC1CCOCC1)C(=O)NCCCCC1CCCC1 159579023 ZAWOLXJYWFCBAR-UHFFFAOYSA-N 296.455 3.415 70 20 CGID Cc1cnc(COC(=O)[C@H]2C[C@H]2c2sccc2C)cn1 159393736 UDFQOELEVLSJCM-OLZOCXBDSA-N 288.372 3.002 70 20 CGID COc1cc(NC(=O)N2CCC[C@H](C)C2)ccc1F 160230231 QRBYBYNTOYEKNB-JTQLQIEISA-N 266.316 3.098 70 20 CGID CCCCOCCCN[C@@H](C)Cc1ccc(O)cc1 160210182 MTUIQGRSBHEJPS-AWEZNQCLSA-N 265.397 3.120 70 20 CGID C[C@H]1CCCC[C@@H]1CNC[C@@H](O)c1ccc(F)cc1 218434201 MNVRQPGDIMTAMM-JGGQBBKZSA-N 265.372 3.275 70 20 CGID COc1ccccc1CN(CCOCC1CC1)C1CC1 159408148 VMBFNGLCWOWDEL-UHFFFAOYSA-N 275.392 3.086 70 20 CGID O=S(=O)(Cl)Cc1ccc(-c2ccccc2)cc1 105829792 SVNFRFPPMHIOIW-UHFFFAOYSA-N 266.749 3.422 70 20 CGID CCCN(CCO)Cc1cc(C(F)(F)F)ccc1F 161221896 HLQNIHLSHFRTCX-UHFFFAOYSA-N 279.277 3.049 70 20 CGID CC(C)n1nccc1C(=O)N[C@H]1C[C@@H]1C1CCCCC1 160098821 YVOPKFANUKIUPE-KGLIPLIRSA-N 275.396 3.163 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1CC1(Cl)Cl 160100306 YCVPZMRWZGPNQH-DTWKUNHWSA-N 290.215 3.436 70 20 CGID COCCCCC(=O)O[C@H](c1ccccn1)C(F)(F)F 160156205 GPLNRORZFFTBMO-GFCCVEGCSA-N 291.269 3.045 70 20 CGID CC(C)c1ccc(OCCN[C@H]2CCN(C)C[C@@H]2C)cc1 160333503 JKUSHDYRQACIEL-YJBOKZPZSA-N 290.451 3.119 70 20 CGID CCOCCC1(CNC(=O)NCC2(CC)CCCC2)CC1 160398401 GIXJTZZKLFJPIB-UHFFFAOYSA-N 296.455 3.463 70 20 CGID CC(C)CCNC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 160416716 ACMRAUXGMAILDR-HNNXBMFYSA-N 292.379 3.022 70 20 CGID CC(C)CC(C)(C)C(=O)N(C)c1ccc2c(c1)OCO2 160423794 NPZKQIFOMJLOJB-UHFFFAOYSA-N 277.364 3.450 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCOC(C)(C)C2)cc1C 160669973 KKIOPLLFXFLBKA-AWEZNQCLSA-N 276.380 3.383 70 20 CGID CC(C)c1cc(=O)n(Cc2c(F)cccc2Cl)cn1 160801158 AATSWBOVBLCILA-UHFFFAOYSA-N 280.730 3.208 70 20 CGID COCc1ccc(C(=O)N2CCc3c(F)cccc3C2)cc1 160806598 JYJUZRPLTJJWSK-UHFFFAOYSA-N 299.345 3.171 70 20 CGID CC(C)CC[C@@H](NCCO)c1ccc(Cl)cc1 159698653 BTOKDCCWPKOUMR-CQSZACIVSA-N 255.789 3.399 70 20 CGID CCC(=O)Nc1ccc(NC(=O)C[C@@H](C)SC)cc1 159891200 YLVYFCOXUKJXQL-SNVBAGLBSA-N 280.393 3.115 70 20 CGID Cc1nc(NC(=O)[C@H](C)c2ccsc2)cc(C2CC2)n1 159948753 HFNLXAYAYDOKFA-SECBINFHSA-N 287.388 3.466 70 20 CGID CC1(C)C[C@H](Nc2cccc(C(F)(F)F)n2)CCO1 159780314 NDCRHLQQJQWOEY-SECBINFHSA-N 274.286 3.470 70 20 CGID O=C(Nc1cccc(F)n1)C1(c2ccccc2)CCC1 160783045 PZNVQVHLIFNGPS-UHFFFAOYSA-N 270.307 3.281 70 20 CGID COc1ccc(OC)c(NC(=O)NCC2CCCCC2)c1 217590929 BOEJVGDOHCUJJU-UHFFFAOYSA-N 292.379 3.406 70 20 CGID CSCCN1CCN(c2cc(Cl)ccc2C)CC1 216824834 RYCQVRHZTLBLPQ-UHFFFAOYSA-N 284.856 3.133 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cscn1 161098562 XZUQOTZWXZXLPD-ZYHUDNBSSA-N 252.383 3.184 70 20 CGID COC[C@@H](NCC1(c2ccc(F)cc2)CC1)C(C)C 161371033 FPHZLNADJZFPII-OAHLLOKOSA-N 265.372 3.118 70 20 CGID CC(C)Oc1ccc(CN[C@@H]2CC(C)(C)OC2(C)C)cn1 160095982 IGOHZBRVVPROAM-CQSZACIVSA-N 292.423 3.305 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1ccoc1C 160143430 SBHAHCMMTJCHTR-CQSZACIVSA-N 271.316 3.014 70 20 CGID CC(=O)c1csc(NC(=O)c2cc(F)c(C)cc2F)n1 160188694 FLYCORANMIZYNA-UHFFFAOYSA-N 296.298 3.185 70 20 CGID CC[C@H](NC(=O)c1cc(C)c(C)o1)c1c(C)noc1C 160213418 HZXMDVXGEFRJFQ-LBPRGKRZSA-N 276.336 3.382 70 20 CGID CN(C(=O)c1ccc(Cl)s1)c1ccc2c(c1)OCO2 160461042 KNZVLEIKKKQSQA-UHFFFAOYSA-N 295.747 3.407 70 20 CGID CN(Cc1cccn1C)C(=O)c1cccc(-n2cccc2)c1 160522667 HBFPLZXJHKLJTF-UHFFFAOYSA-N 293.370 3.088 70 20 CGID CCCCN(C)C(=O)CSc1nc2cc(F)ccc2o1 160695955 FBFFEYAABZGETC-UHFFFAOYSA-N 296.367 3.318 70 20 CGID CCc1ccc([C@H](CO)NC[C@@H]2CC=CCC2)cc1 160766905 APCRQXJFFRCBDP-WBVHZDCISA-N 259.393 3.228 70 20 CGID CCc1ncsc1C(=O)Nc1cc(CC(C)(C)C)n[nH]1 160887293 BDGWLFULLWZJTG-UHFFFAOYSA-N 292.408 3.270 70 20 CGID Cc1cc2cc(NC(=O)[C@@H]3CCC(=O)C[C@@H]3C)ccc2[nH]1 159851742 OYAKVFKAPNIEBS-ZUZCIYMTSA-N 284.359 3.420 70 20 CGID O=C(NC[C@H](c1ccccc1)N1CCCC1)C1=CCCC1 159664916 IZGWYVPUVCMTQV-QGZVFWFLSA-N 284.403 3.050 70 20 CGID CCC(C)(C)NC(=O)[C@@H](C)Nc1ccn(CCC(C)C)n1 159885987 QIRULKBSLLMSLD-CYBMUJFWSA-N 294.443 3.034 70 20 CGID CSC[C@H](C)C(=O)O[C@H](c1ccccn1)C(F)(F)F 159911376 OEFSVCGFWPKHEV-WCBMZHEXSA-N 293.310 3.227 70 20 CGID CCC(C)(CC)C(=O)N[C@@H]1CC(C)(C)OC1(C)C 159529004 SDFVJISJJKGCCG-LLVKDONJSA-N 255.402 3.275 70 20 CGID CCSc1cc(Cl)ccc1C(=O)Nc1ccnn1C 159591253 XMEIBFGPYUYFHO-UHFFFAOYSA-N 295.795 3.438 70 20 CGID CC1(C)C[C@@H](Nc2nnc(C(C)(C)C)s2)CCO1 160722326 AWOAXMODQJJYIB-VIFPVBQESA-N 269.414 3.205 70 20 CGID CCS[C@@H]1CCC[C@H]1NC(=O)c1ccc(Cl)nc1C 160654158 NJHCHGVNBFIWKD-VXGBXAGGSA-N 298.839 3.447 70 20 CGID CS[C@@H](C)CNc1cc(Cl)nc(C2CC2)n1 161056676 OVQHXBLPAPITLV-ZETCQYMHSA-N 257.790 3.171 70 20 CGID C[C@H](c1cc(F)ccc1F)N(C)C(=O)[C@H]1CCCCO1 161165903 RGDTYCCEPRGFRB-QMTHXVAHSA-N 283.318 3.053 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCCc1cc(C)ccc1OC 160170097 IFEKKSGKAFMJPF-WMLDXEAASA-N 275.392 3.099 70 20 CGID COC[C@H](NC(=O)Nc1cccc(CSC)c1)C1CC1 160241148 RIGNHUHVDLLGAF-AWEZNQCLSA-N 294.420 3.096 70 20 CGID Cc1cc(-c2cncc(F)c2)nc2cc3c(cc12)OCO3 160638337 UCKIFDGHUZULTQ-UHFFFAOYSA-N 282.274 3.473 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@@H](CC)c1c(C)noc1C 160755218 PCLJUVPPJFQADR-STQMWFEESA-N 282.384 3.064 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@H](C)Cc1ccc(Cl)cc1 160798623 BHCCUNCIYDEWAI-DOMZBBRYSA-N 297.826 3.042 70 20 CGID O=C(C1CCC(F)(F)CC1)N1CCCc2cccc(O)c21 160981737 KSYWDVPDKCSLJO-UHFFFAOYSA-N 295.329 3.497 70 20 CGID Cc1cccc([C@H]2CCCN2CCn2ccnc2)c1 159769832 QCTJTFGOBSFXSR-MRXNPFEDSA-N 255.365 3.029 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCOC(C)(C)C2)c(F)c1 159952347 LBGFUWGIIPWTGO-NWDGAFQWSA-N 281.371 3.443 70 20 CGID COCCOCCCCNCc1ccc(F)c(Cl)c1 160144560 ICVLAYSNUCTBMM-UHFFFAOYSA-N 289.778 3.012 70 20 CGID CCc1ncnc(N[C@H](C)COc2ccc(C)cc2)c1F 217992836 LUWKLNBSEDVUCW-GFCCVEGCSA-N 289.354 3.366 70 20 CGID C[C@H]1C[C@@H]1c1ccc(CNC[C@@H](O)c2ccccc2)o1 217634928 WGWANKXRIJLYKD-VBNZEHGJSA-N 271.360 3.226 70 20 CGID CN1CCN(Cc2ccc(-c3ccc(F)cc3)s2)CC1 218043571 YBASUIQUNBRBGT-UHFFFAOYSA-N 290.407 3.302 70 20 CGID O=S(=O)(Cl)C[C@@H](F)c1cccc(C(F)(F)F)c1 1537958781 KIAJEJVSYJPYPF-MRVPVSSYSA-N 290.665 3.285 70 20 CGID CC[C@@H](C)N(C)CCNCc1ccccc1OC(C)C 217375027 NQSZTNCDQADCMN-OAHLLOKOSA-N 278.440 3.294 70 20 CGID COC(=O)c1ccc(N[C@H]2CCC[C@@H](SC)C2)nc1C 218023418 OSQJDRLCTHXSIF-NWDGAFQWSA-N 294.420 3.263 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C2=CCCC2)n1 161354930 HOSLCHVUYGDFTH-UHFFFAOYSA-N 282.347 3.083 70 20 CGID CCCCOc1ccccc1NC(=O)N[C@@]1(C)CCOC1 161485918 AGQHDSMADZDYPM-INIZCTEOSA-N 292.379 3.166 70 20 CGID COc1cc(NCc2scnc2C)ccc1F 160147551 CGDIPUIOZHIEKC-UHFFFAOYSA-N 252.314 3.211 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](C)c2cnccn2)C1 159404247 ICDDDQNFMNVTDQ-YNEHKIRRSA-N 265.426 3.192 70 20 CGID CC[C@H](NC[C@H](C)N1CCc2ccccc2C1)C1CC1 159833760 IDAVENHFCABAKH-KSSFIOAISA-N 272.436 3.211 70 20 CGID C[C@H]1CC(C)(C)CC[C@H]1NC(=O)N(C)CC1CCOCC1 159645215 SDUBWJZUIAICLK-DZGCQCFKSA-N 296.455 3.269 70 20 CGID C[C@@H](CCn1cccn1)Nc1cccc2ncccc12 159392982 FCAWFQZXYPQECL-ZDUSSCGKSA-N 266.348 3.322 70 20 CGID CC(C)(C)c1nsc(NC[C@@](C)(O)c2cccs2)n1 159592712 VTOIIVINQAOWFU-CYBMUJFWSA-N 297.449 3.217 70 20 CGID CCCn1nccc1CN[C@H](C)c1ccc(F)cc1F 160015526 HSTHQRFIXACOMH-LLVKDONJSA-N 279.334 3.422 70 20 CGID CC1(NC(=O)NCc2ccc(Br)cc2)CCC1 160920782 ZDUDDACHHJVVPD-UHFFFAOYSA-N 297.196 3.191 70 20 CGID C[C@H](CCC(C)(C)C)NC(=O)[C@@H](N)c1ccccc1 161230643 JZRLBZQNGZUOBV-OCCSQVGLSA-N 262.397 3.017 70 20 CGID C[C@@H]1CC/C(=C\C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 809281108 GRAZVZIMLLZSDF-MXBGMFSPSA-N 297.351 3.030 70 20 CGID CC[C@H](NC(=O)c1ccc(Cl)c(F)c1)c1ncc[nH]1 218078226 LQUJIIZUVUYDCB-NSHDSACASA-N 281.718 3.083 70 20 CGID CCOc1cc2c(cc1CN[C@H]1CCSC1)O[C@H](C)C2 218606633 UQZHDFVWEFLYFG-RISCZKNCSA-N 293.432 3.004 70 20 CGID COC[C@H](NC(=O)Nc1cc(C)ccc1Cl)C1CC1 161057729 SVMJTZRGUDOTOG-ZDUSSCGKSA-N 282.771 3.195 70 20 CGID CC[C@H](NCCCOCc1ccc(OC)cc1)C1CC1 161100369 ZQPXDBMLGBGFKJ-KRWDZBQOSA-N 277.408 3.380 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)NCc1nc2ccccc2s1 161406716 GJDVFDPTYNBXCE-QWRGUYRKSA-N 289.404 3.379 70 20 CGID CC(C)[C@@H](CNC(=O)[C@H]1CCCCO1)c1ccccc1 161429352 AOSXWAQHAPDRPX-HZPDHXFCSA-N 275.392 3.112 70 20 CGID CCc1noc(C)c1CSCCc1ccccn1 160009762 PZXWHPFEFWSLJF-UHFFFAOYSA-N 262.378 3.416 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccnc2ccccc12 160066217 SZVMEEWBVDCYQK-UHFFFAOYSA-N 266.344 3.155 70 20 CGID C[C@H]1C[C@@H](C)CCN(C(=O)Nc2ccc(N(C)C)nc2)C1 160083848 CZOARFVNCLZDTR-STQMWFEESA-N 290.411 3.048 70 20 CGID CCOCCCSCCC(=O)N(C)c1ccccc1 160137518 ONBVRDKSJLLNNK-UHFFFAOYSA-N 281.421 3.199 70 20 CGID CC1=C(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)CCCO1 160148983 PZDREIDBYGRLNJ-CQSZACIVSA-N 293.407 3.069 70 20 CGID O=C(NCC1(C2CC2)CC1)N1CCc2cccc(F)c2C1 160215158 QSQAYMUHPOUDBJ-UHFFFAOYSA-N 288.366 3.084 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)C[C@@H](CC)c1ccccc1 160414958 KHMFOICAQJEJKR-UONOGXRCSA-N 291.391 3.028 70 20 CGID CC[C@@H](C)[C@H](C)NC(=O)Nc1ccn(CC(F)(F)F)n1 160571088 PNIYUDYGXLNXRW-BDAKNGLRSA-N 292.305 3.002 70 20 CGID Cc1ncc(CNC(=O)NCC2CCC(C)(C)CC2)s1 160756628 QEUKDMDIPZQSLS-UHFFFAOYSA-N 295.452 3.467 70 20 CGID CCCC1(CNC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)CC1 160858442 KWBXTODZBHNCEV-PBWFPOADSA-N 277.408 3.078 70 20 CGID CCOCCN(CC)C(=O)[C@@H](CC)c1ccc(F)cc1 159875425 BNTYRUNCZOXPJV-HNNXBMFYSA-N 281.371 3.204 70 20 CGID CCC(C)(CC)C(=O)Nc1cc(OC)c(OC)cc1OC 159480472 YFELZAMLYCEVJB-UHFFFAOYSA-N 295.379 3.477 70 20 CGID C[C@@H](NCCO)c1ccc(-c2ccccc2F)s1 159680406 YJSLPHBEYSAEMK-SNVBAGLBSA-N 265.353 3.197 70 20 CGID Cc1cc(NC(=O)CC[C@H](C)c2ccccc2)c[nH]c1=O 159492152 UJKONOPPBNFCIP-LBPRGKRZSA-N 284.359 3.206 70 20 CGID CCN(Cc1ccccn1)c1nc(C(C)(C)C)ns1 159895155 IDOCVNHDCBNPKZ-UHFFFAOYSA-N 276.409 3.257 70 20 CGID CC(C)CC1(CNC(=O)NC2C[C@@H](C)O[C@H](C)C2)CC1 159909278 SZUGGLWLGUZESQ-CHWSQXEVSA-N 282.428 3.068 70 20 CGID CN(Cc1ccc(F)cc1Cl)C[C@H]1CCC[C@@H]1O 159464048 CVEXZZWDKFXRHD-RISCZKNCSA-N 271.763 3.072 70 20 CGID FC(F)n1ccnc1CN1CC[C@@H]2CCCC[C@@H]21 159596107 BCQVJHDHEVNGKF-QWRGUYRKSA-N 255.312 3.043 70 20 CGID Cc1cnc(C)c(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 160234076 QSRHQNNJDWTUEK-SUMWQHHRSA-N 296.418 3.026 70 20 CGID CC1(C)CCC[C@H]1C(=O)Nc1cccc(S(=O)(=O)F)c1 809282296 BTHSRCZVVYDRMO-LBPRGKRZSA-N 299.367 3.110 70 20 CGID Brc1ccc(CCNCC2CC2)s1 218138584 GCVPQTOLMMSPHO-UHFFFAOYSA-N 260.200 3.053 70 20 CGID CC(C)N(CCSCc1nccs1)C(C)C 161058910 BMSXXTBQDJEKHD-UHFFFAOYSA-N 258.456 3.495 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cccc(COCC2CC2)c1 161387959 GJIIMKDDBJJSKE-CYBMUJFWSA-N 291.391 3.367 70 20 CGID CC(C)CCn1ccc(NC(=O)NCc2ccccc2)n1 161403429 FVTDLLSFHKWBJE-UHFFFAOYSA-N 286.379 3.251 70 20 CGID COCc1nc(C(=O)NCC(C)(C)C2CCCC2)cs1 160102302 AVIPSTLRLSWWTL-UHFFFAOYSA-N 296.436 3.236 70 20 CGID COCc1ccc(C(=O)N[C@H]2CCCc3sccc32)o1 160208325 NXYQJBZGOHAAQP-LBPRGKRZSA-N 291.372 3.295 70 20 CGID CCOCCC1(C(=O)NCc2ccc(F)cc2)CCC1 160649991 HGFVMHYPRJNULD-UHFFFAOYSA-N 279.355 3.039 70 20 CGID Cc1ccc(C)c([C@@H](C)NCCNC(=O)c2ccccc2)c1 160710853 XJANPUWJHZPWKP-MRXNPFEDSA-N 296.414 3.384 70 20 CGID Cc1ccc(NC(=O)C[C@H](C)c2c(C)noc2C)cn1 160849929 WXCYTJDAJSFFNH-VIFPVBQESA-N 273.336 3.127 70 20 CGID CCO[C@H](CCNC(=O)C[C@H](C)c1ccncc1)C(C)C 160971585 IFSGPFJQXLPAPQ-GOEBONIOSA-N 292.423 3.143 70 20 CGID Cc1cc(NC(=O)C[C@H]2CCCCC2(C)C)c[nH]c1=O 159845907 YEGHJIFBGWKROL-GFCCVEGCSA-N 276.380 3.228 70 20 CGID Cc1[nH]ncc1CCCNCc1coc2ccccc12 161099013 WUNJTNQIUVIZGM-UHFFFAOYSA-N 269.348 3.187 70 20 CGID CNCCC1CCN(Cc2cc(F)cc(Cl)c2)CC1 161143577 QEVRLGUCXDJBIX-UHFFFAOYSA-N 284.806 3.301 70 20 CGID C[C@@H](C(=O)Nc1cccc(S(=O)(=O)F)c1)C1CCCC1 809281772 XVVDYFPWMSKFIG-SNVBAGLBSA-N 299.367 3.110 70 20 CGID Nc1cc(F)cc(C(=O)OCC2CCCCC2)c1F 217922623 QWTFYLDXWCILEY-UHFFFAOYSA-N 269.291 3.284 70 20 CGID C[C@@H](NCCCN(C)C(=O)OC(C)(C)C)c1cscn1 218241672 IKTYSULXCXPYDS-LLVKDONJSA-N 299.440 3.051 70 20 CGID CC[C@@H]1C[C@H]1NC(=O)c1cc(C)ccc1Br 217822201 ZPZRMBQOYJKUPK-BXKDBHETSA-N 282.181 3.286 70 20 CGID COC(=O)N1CCC(c2ccc(Br)cc2)CC1 217258166 IRADGBHKZKGVDB-UHFFFAOYSA-N 298.180 3.395 70 20 CGID Cc1cc(F)c(C(=O)NCc2cccc(F)c2)cc1F 161028740 NHDFGBPYXRAWNW-UHFFFAOYSA-N 279.261 3.342 70 20 CGID CCC(CC)(CN)C(=O)NCCCCCc1ccccc1 161210591 FFJXKBWWGMEPLK-UHFFFAOYSA-N 290.451 3.281 70 20 CGID CC[C@H](C(=O)NCC1(CCOC)CC1)c1ccc(F)cc1 161261615 NLTBGVRNECECNI-HNNXBMFYSA-N 293.382 3.252 70 20 CGID CS[C@@H](C)CNC(=O)[C@H](OC(C)(C)C)c1ccccc1 161311007 TYLGBMJJSAYHDT-GXTWGEPZSA-N 295.448 3.411 70 20 CGID CN(C[C@@H]1CCOC1)C(=O)C[C@H]1CCCCC1(C)C 161395530 JYYFIFZYSPOXPH-UONOGXRCSA-N 267.413 3.088 70 20 CGID COc1ccc(COCCC(=O)N2[C@@H](C)CC[C@@H]2C)cc1 161505832 HPEZWGAKSPLGKI-KBPBESRZSA-N 291.391 3.001 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1cncc(F)c1 160120413 IUUIVIPJIUUGJS-NSHDSACASA-N 289.306 3.456 70 20 CGID C[C@H](CC(=O)N1CCN(C)c2ccccc21)c1ccncc1 160545370 CIMKFDOIHFEDID-CQSZACIVSA-N 295.386 3.058 70 20 CGID C[C@H](C(=O)N(C)c1ccc2c(c1)OCO2)c1ccsc1 160567521 VWUSYPLCLOYZLI-JTQLQIEISA-N 289.356 3.243 70 20 CGID CC1(C)C[C@@H](Nc2nc3ccccc3cc2CO)CCO1 160583797 QAUDMGDAQNSVEM-AWEZNQCLSA-N 286.375 3.097 70 20 CGID COC[C@H]1CCCN1C(=O)C[C@H](C)c1ccc(F)cc1F 160882544 ZAYHBKQPKICQER-WCQYABFASA-N 297.345 3.096 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCCc1cccc(Cl)c1 159839315 FLIIAIFRNYFMJC-HIFRSBDPSA-N 265.784 3.435 70 20 CGID C[C@@H]1CCCN(C(=O)N[C@H]2CCCc3cc(N)ccc32)C1 159440472 LDSMYQMFZXJNEJ-WBMJQRKESA-N 287.407 3.088 70 20 CGID CCOc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159475746 SOWKZUNPBFZLQG-IKGGRYGDSA-N 287.403 3.133 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)[C@@H](C)c2ccccn2)o1 159484427 QCHHNAJPSMWMBT-NHAQELONSA-N 284.359 3.470 70 20 CGID CCC[C@H](Nc1ccn(CCC(C)C)n1)C(=O)OCC 159895895 TZYRRFNKCJISIL-ZDUSSCGKSA-N 281.400 3.073 70 20 CGID Clc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)s1 159540647 DCBCARBPKXHMRL-RTXFEEFZSA-N 283.824 3.449 70 20 CGID Clc1ccccc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159616057 CLRZQCYUAZTCQO-YUELXQCFSA-N 277.795 3.387 70 20 CGID Cc1ccc(C(=O)N2CCS[C@@H]3CCCC[C@H]32)cc1N 161430994 HVAJYLVPTWRXMR-HUUCEWRRSA-N 290.432 3.077 70 20 CGID COc1cc(NCCc2scnc2C)ccc1F 160245338 GZEJZDAYTNTTRW-UHFFFAOYSA-N 266.341 3.254 70 20 CGID COc1ccccc1[C@@H]1CCCN1CCOCC1CC1 160421552 MHHXCQNZUJXMPH-INIZCTEOSA-N 275.392 3.259 70 20 CGID CCCC[C@@H](CNC(=O)OC(C)(C)C)NCC(C)C 218121978 LNGNWQPEUFUEFM-ZDUSSCGKSA-N 272.433 3.316 70 20 CGID CC(C)N(CCSCC(=O)c1ccc[nH]1)C(C)C 161040683 IBDKEFDKZZGQFY-UHFFFAOYSA-N 268.426 3.049 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CC=CCC2)o1 161215043 SGKAGNAFKXKFPC-ZFWWWQNUSA-N 289.375 3.446 70 20 CGID CCCC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 161246896 BPFRVLYDULZIKD-LLVKDONJSA-N 267.756 3.120 70 20 CGID C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cccs1 161289534 WBPHELSXHQCODJ-SNVBAGLBSA-N 291.347 3.279 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C[C@@H]2C=CCC2)n1 161348053 LMYORMPPSTXBBO-GFCCVEGCSA-N 296.374 3.329 70 20 CGID CNC(=O)c1ccccc1NCCc1ccc(Cl)cc1 161394235 UTIJWOQMVYKUBB-UHFFFAOYSA-N 288.778 3.354 70 20 CGID CC[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC[C@@H]1N 160237488 SEBSZUSHLDAIHI-JJTUDDRGSA-N 292.467 3.179 70 20 CGID CC(C)(C)CC(C)(C)NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 160281036 JJBOVQSPLZQHCY-UONOGXRCSA-N 296.455 3.458 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](COC)C(C)C)C1 159433735 YAOSTAGEFVCFLH-MCIONIFRSA-N 259.459 3.311 70 20 CGID CN(C(=O)Nc1cccc(Cl)c1F)[C@@H]1CCSC1 159656861 KSZWDFPVQJNPKU-MRVPVSSYSA-N 288.775 3.448 70 20 CGID O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1=CCCC1 159665064 IZGWYVPUVCMTQV-KRWDZBQOSA-N 284.403 3.050 70 20 CGID CCOCCCC(=O)N[C@@H]1CCCc2sccc21 159867648 LSRIHOVXGCWVIB-GFCCVEGCSA-N 267.394 3.058 70 20 CGID C[C@@H]1CCN(C(=O)Nc2nnc(C(C)(C)C)s2)C[C@@H]1C 159763024 SBTRVNHOPVIIPM-ZJUUUORDSA-N 296.440 3.345 70 20 CGID C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCn1cccc1 159574452 RQQASCWVBDJLIY-PMPSAXMXSA-N 274.408 3.448 70 20 CGID CC[C@]1(C)CCCN(CCCN2CCCCC2)C1 161310899 HMKNFICJMHZLQZ-MRXNPFEDSA-N 252.446 3.375 70 20 CGID CC(C)Oc1ccc(Cl)cc1S(=O)(=O)Cl 88270348 JBRFIUDIMPOLEM-UHFFFAOYSA-N 269.149 3.055 70 20 CGID Cc1cc(C(N)=O)ccc1NCc1coc2ccccc12 161077512 NZTBKEDKSHTUDH-UHFFFAOYSA-N 280.327 3.452 70 20 CGID Cc1cccc(CNC2(c3noc(C)n3)CCCC2)c1 161369974 AFYSWENSMWTEMP-UHFFFAOYSA-N 271.364 3.246 70 20 CGID CC(C)Cc1noc(-c2csc([C@H]3CCCO3)n2)n1 161506081 ZLRSUEFRRMYAGO-SNVBAGLBSA-N 279.365 3.243 70 20 CGID C/C(=C/c1ccccc1Cl)C(=O)NC1(C)CCOCC1 161509468 HGKHBSRVKKGXSO-QXMHVHEDSA-N 293.794 3.429 70 20 CGID CCCn1nccc1CN[C@@H](C)Cc1ccccc1OC 160100197 FYFVCOBELZVNIS-AWEZNQCLSA-N 287.407 3.023 70 20 CGID CN(C(=O)CC1=CCCCC1)c1ccc2c(c1)OCO2 160153013 MLFLXUGYLJHUBH-UHFFFAOYSA-N 273.332 3.269 70 20 CGID CN(C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1)C1CC1 160509091 XXECSZJAVFUUHD-HOCLYGCPSA-N 272.392 3.202 70 20 CGID Cc1n[nH]c(C(C)C)c1C(=O)N[C@@H]1CCc2ccccc21 159441120 IYFRUGVGGFNGDH-CQSZACIVSA-N 283.375 3.259 70 20 CGID Cc1ccccc1-n1cc(C(=O)NCC2(C3CC3)CC2)cn1 159948880 RGICJBHLOROXPA-UHFFFAOYSA-N 295.386 3.101 70 20 CGID CC[C@@H](C)[C@@H](C)N(C(=O)NCCc1cscn1)C1CC1 159551304 TWFAHKICDQGPIQ-VXGBXAGGSA-N 295.452 3.294 70 20 CGID CSC[C@@H]1CCCN1C(=O)Nc1ccnc(C)c1Cl 159385119 XWMDCJQDLGZAPV-JTQLQIEISA-N 299.827 3.403 70 20 CGID CC[C@H](C)OCC(=O)Nc1cccc(C)c1Cl 159572008 HNNRUIWGARVAPJ-JTQLQIEISA-N 255.745 3.402 70 20 CGID Cc1nccc(NC(=O)N2CCC[C@@H](C)C2)c1Cl 159787585 CKYOEHKRSTWSMO-SECBINFHSA-N 267.760 3.307 70 20 CGID C[C@H]1C[C@@H](NC(=O)CCc2cncc(F)c2)CC[C@H]1C 159793283 JBCCFVLHEVPWGW-XUJVJEKNSA-N 278.371 3.094 70 20 CGID COc1cc(NCc2cn3ccccc3n2)ccc1F 160033521 PZTAHASFMFPYKY-UHFFFAOYSA-N 271.295 3.094 70 20 CGID Cc1ccc(CN[C@@H](C)CSC(C)(C)C)cn1 161291549 IYKORIVSQFIEDN-LBPRGKRZSA-N 252.427 3.400 70 20 CGID CCn1ccnc1CN1CCC[C@H]1c1ccccc1 160738884 UCKAFTHIAVNGRF-HNNXBMFYSA-N 255.365 3.240 70 20 CGID Cc1cnc(CN[C@@H]2C[C@H]3CC[C@@]2(C)C3(C)C)cn1 218493189 XWWCYOKGTCYGQX-XNRPHZJLSA-N 259.397 3.089 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCc2ccccc21 161043743 LNWQGKISRMWRID-UHFFFAOYSA-N 283.375 3.447 70 20 CGID Cc1cc(C(=O)N[C@@H](C)c2cc3ccccc3o2)ncn1 161280337 RUYXVVILZZAPAO-NSHDSACASA-N 281.315 3.022 70 20 CGID Cc1nccn1CCCCN(C1CCCC1)C1CC1 161379276 MXTQLVUBNVPUMO-UHFFFAOYSA-N 261.413 3.379 70 20 CGID Cc1ccc(OC(F)F)c([C@H](C)NC2CCN(C)CC2)c1 161428378 DSEREDKZRZCJDP-LBPRGKRZSA-N 298.377 3.341 70 20 CGID CCCCn1ncc(NC(=O)NC2CCCCC2)c1C 160116632 FZKJZHJHJRGQSB-UHFFFAOYSA-N 278.400 3.446 70 20 CGID C[C@H](NCCN(C)Cc1ccc(F)cc1)c1cncs1 160119328 TUCMGRHCYHPCGQ-LBPRGKRZSA-N 293.411 3.065 70 20 CGID C[C@@H](C(=O)N1CCCCC1)c1c(F)cccc1F 160446186 UXZUGWDSJBRSCW-SNVBAGLBSA-N 253.292 3.081 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)C(=O)NCCc1cccs1 160585987 DSSMAPSGNWQYAM-KGLIPLIRSA-N 296.480 3.163 70 20 CGID C[C@H](c1nc2ccccc2s1)[C@@H](C)NCC(C)(C)O 160621153 WVLZAICZGAWCSA-WDEREUQCSA-N 278.421 3.149 70 20 CGID CCCC1(CNC(=O)c2cc(C(C)C)nn2CC)CC1 160622034 YNGNKCSPPNVESH-UHFFFAOYSA-N 277.412 3.337 70 20 CGID COc1csc(C(=O)NCCCSCC(C)C)c1 160755168 BWNRPLMCDJQJNQ-UHFFFAOYSA-N 287.450 3.266 70 20 CGID COC(=O)c1csc(NC(=O)N(C)C2CCCCC2)c1 160981105 RKDNDCLMGQMENJ-UHFFFAOYSA-N 296.392 3.331 70 20 CGID O=C(Cc1ccccc1Cl)NCC1(C2CC2)CC1 159696354 VCTNVYLYDBJTLR-UHFFFAOYSA-N 263.768 3.189 70 20 CGID C[C@H](NC[C@@H](C)N1CCc2ccccc21)c1cncc(F)c1 159931027 VWKAXVVKHJLULF-KGLIPLIRSA-N 299.393 3.323 70 20 CGID Cc1nc(NC(=O)[C@@H](C)c2ccsc2)cc(C2CC2)n1 159948667 HFNLXAYAYDOKFA-VIFPVBQESA-N 287.388 3.466 70 20 CGID CC1(C)C[C@@H](NCc2csc(C3CC3)n2)CCO1 160543415 NFCSGYDVVYAUAQ-NSHDSACASA-N 266.410 3.068 70 20 CGID CCc1nn(C)cc1CNCc1cc(F)cc(Cl)c1 160977100 QTPFJTGAQOKFTR-UHFFFAOYSA-N 281.762 3.065 70 20 CGID CC(C)CCNC(=O)NCc1ccc(Br)cc1 217315546 MOXQZTWNYBSUHY-UHFFFAOYSA-N 299.212 3.294 70 20 CGID CC[C@H](COC)NCCc1ccc(OC(F)(F)F)cc1 161166491 SMUVJZYCJVCBFD-GFCCVEGCSA-N 291.313 3.142 70 20 CGID Cc1ccc(C(=O)N2CCC[C@@H](CC(C)C)C2)cc1N 161473700 QJDPFLZECVDWTQ-AWEZNQCLSA-N 274.408 3.476 70 20 CGID C[C@H]1CCC[C@@H](C(=O)N(Cc2ccncc2)C2CC2)C1 161474166 GCJAKUALEDARLH-DZGCQCFKSA-N 272.392 3.399 70 20 CGID CC(C)CCC1CCN(C(=O)NCc2ccccn2)CC1 160251829 GLHZBQKPLKRSHH-UHFFFAOYSA-N 289.423 3.439 70 20 CGID Cc1nc(CCN[C@@H](C)c2nc(C(C)(C)C)no2)cs1 160270638 XLCWDCCZQYYSSQ-VIFPVBQESA-N 294.424 3.025 70 20 CGID CCn1ccnc1CN1CCC[C@@H]1c1cccc(OC)c1 160737524 MFANMBJVYGZWOT-MRXNPFEDSA-N 285.391 3.249 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)c1ccc(F)cc1 160822114 BVJLYRWIMWETHN-SNVBAGLBSA-N 291.347 3.279 70 20 CGID CCc1cc(O)nc(CN(C)[C@@H](C)c2ccccc2F)n1 160902807 ZGOHYZYUAUQOAP-NSHDSACASA-N 289.354 3.077 70 20 CGID CC(C)N(Cc1cnc2ccccn12)C1CCCC1 159601978 OBJMCKBRKVNKBJ-UHFFFAOYSA-N 257.381 3.487 70 20 CGID CCC1CCC(NC(=O)c2cccc(-c3ncn[nH]3)c2)CC1 159448384 XEJFRIDEYQGEIA-UHFFFAOYSA-N 298.390 3.170 70 20 CGID CCCn1ccc2ccc(NC(=O)[C@H]3CC[C@H](N)C3)cc21 159851415 SUDUIBRIYWTBPN-KBPBESRZSA-N 285.391 3.117 70 20 CGID COc1ccc(N(C)C(=O)c2ccsc2)cc1F 159551866 KCTPSARKQHQNSO-UHFFFAOYSA-N 265.309 3.172 70 20 CGID CC(C)n1ncc(C(=O)N(C)c2ccccn2)c1C1CC1 159964931 PGSYTOKTUHVHNT-UHFFFAOYSA-N 284.363 3.013 70 20 CGID Cc1ccccc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159561496 XAIJZGSBURXJEG-OAGGEKHMSA-N 257.377 3.042 70 20 CGID CCS[C@@H]1CCC[C@@H]1Nc1ccc(C(=O)OC)c(C)n1 218056294 BNTCGQPVBBKYMS-QWHCGFSZSA-N 294.420 3.263 70 20 CGID COc1ccc(CN(C)[C@H](C)C(=O)OC(C)C)cc1Cl 161239514 GBXKKSNSRBSGEB-LLVKDONJSA-N 299.798 3.121 70 20 CGID CN(C(=O)C[C@@H]1CCCN1)c1ccc(-c2ccccc2)cc1 161083369 OJMOYLYMCUMURU-KRWDZBQOSA-N 294.398 3.459 70 20 CGID CN1CCC(N[C@H]2CCCOc3c(Cl)cccc32)CC1 161445274 CDVUKHMXTYWKAK-HNNXBMFYSA-N 294.826 3.238 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1nccs1 160031207 PGKKCHWCWOBDOR-BDAKNGLRSA-N 264.375 3.255 70 20 CGID CC[C@H](C)OCC(=O)N[C@H]1CCCc2sccc21 160125477 WHIPVJWPVCTWDZ-JQWIXIFHSA-N 267.394 3.057 70 20 CGID COc1ccc(N(C)C(=O)C[C@H]2CCCCO2)cc1Cl 160148395 CLVMXDWMSMXEEK-GFCCVEGCSA-N 297.782 3.271 70 20 CGID Cc1csc(CCCCN[C@H](C)C2CCOCC2)n1 160723210 HQHZLRZHOOWRRM-CYBMUJFWSA-N 282.453 3.179 70 20 CGID CC[C@H](NCCCc1cnn(C)c1)c1ccc(F)cc1F 160868061 CKPMVUVEQXOOEV-INIZCTEOSA-N 293.361 3.372 70 20 CGID CC(C)CONC(=O)Nc1cccc(C(F)F)c1 159823247 JHKKKQGOCRHEBR-UHFFFAOYSA-N 258.268 3.333 70 20 CGID CC1CCC(C)(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)CC1 159659250 PNNPEVDITUMUJT-MTKIKNGMSA-N 294.439 3.212 70 20 CGID O=C(CSC(F)(F)F)N[C@@H]1CCCc2sccc21 159897716 KWATZBWRKXMJQJ-MRVPVSSYSA-N 295.351 3.495 70 20 CGID CCC[C@H](C)NC(=O)[C@H](C)Nc1ccn(CCC(C)C)n1 159921722 RZBOILXSKLPYCQ-KBPBESRZSA-N 294.443 3.034 70 20 CGID CC[C@H](Nc1ccc2oc(C(C)C)nc2c1)C(=O)OC 159528059 UQPQNRPHTMYGED-NSHDSACASA-N 276.336 3.315 70 20 CGID CCOc1ccc(CNC(=O)Nc2cc(C)ccn2)cc1 217301022 RYNMLGGXZJLRNA-UHFFFAOYSA-N 285.347 3.110 70 20 CGID Cc1cccc(OC[C@H](O)CNC[C@@H]2CCCC[C@H]2C)c1 218442724 QRPXNXQEEHYSOP-IXDOHACOSA-N 291.435 3.151 70 20 CGID CC(C)CCNC(=O)NCc1ccccc1Br 217314384 UBJULDWYENDFEM-UHFFFAOYSA-N 299.212 3.294 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@]2(C)CC)n1 161024043 HJNGKCOFPMYWRT-SJCJKPOMSA-N 298.390 3.409 70 20 CGID CCO[C@H]1C[C@H](N[C@@H](C)c2cnccn2)C1(CC)CC 161300815 OYONRWVISDMMML-QEJZJMRPSA-N 277.412 3.111 70 20 CGID CCN(Cc1ccccc1Cl)C(=O)c1cc(C)ncn1 161482577 IYANGTLOXFRSDM-UHFFFAOYSA-N 289.766 3.101 70 20 CGID Cc1cccc([C@@H](O)CNc2nc(C(C)(C)C)ns2)c1 160011819 XKCXPHULVARHAJ-LBPRGKRZSA-N 291.420 3.290 70 20 CGID CCCCn1ncc(C(=O)NCCc2cccs2)c1C 160019967 DADURYLVLARILN-UHFFFAOYSA-N 291.420 3.026 70 20 CGID CC[C@@H](NCCOc1ccc(Cl)cc1)[C@H]1CCOC1 159640881 ICGRTQACGUZEDM-SWLSCSKDSA-N 283.799 3.124 70 20 CGID Cn1ccc(CNC(=O)c2ccc(C(C)(C)C)s2)c1 159473794 OXJMQQFECSQCKB-UHFFFAOYSA-N 276.405 3.314 70 20 CGID Cc1ccccc1CC(=O)N[C@H]1CCOC2(CCCC2)C1 159917338 COXLCOFJFXLRBO-INIZCTEOSA-N 287.403 3.146 70 20 CGID CNC[C@H](C)C(=O)N1CCC[C@H](C)[C@H]1c1ccc(C)cc1 159781855 HBDRCDHCJJYYAE-ZOBUZTSGSA-N 288.435 3.150 70 20 CGID CCc1noc(C)c1CSCc1nnc(C2CC2)o1 159980050 ZEAOFZKPSARRBD-UHFFFAOYSA-N 279.365 3.239 70 20 CGID CN(C)[C@@H]1CCC[C@H](Nc2nc(C(C)(C)C)ns2)C1 159842348 LHCVIWDVQPDUCX-WDEREUQCSA-N 282.457 3.120 70 20 CGID C[C@@H]1CCCN(C(=O)NCC2C(C)(C)C2(C)C)C1 160670152 BABUPMPCAZXPGD-LLVKDONJSA-N 252.402 3.110 70 20 CGID CCC(CC)(CNC(=O)N1CCCCCC1)SC 218004289 WRSRTDCWYDIXSH-UHFFFAOYSA-N 272.458 3.494 70 20 CGID COc1ccc(COCCCN[C@H](C)C2(C)CC2)cc1 161095238 UEZCEODITOQQNK-CQSZACIVSA-N 277.408 3.380 70 20 CGID COc1ccc(F)cc1[C@@H](C)NC(=O)C[C@H](C)SC 160083431 PGOPFCQPWJJYHD-VHSXEESVSA-N 285.384 3.153 70 20 CGID C[C@H](CCOc1ccccc1)C(=O)NCC1(C2CC2)CC1 160103278 YYAIJXAJQCDZTA-CQSZACIVSA-N 287.403 3.398 70 20 CGID C[C@@H]1CC[C@@H](C)N1CC1CCN(C(=O)C(C)(C)C)CC1 160148878 NXHTZBLPDVDNOP-ZIAGYGMSSA-N 280.456 3.144 70 20 CGID CC[C@H](OC1CCCCC1)C(=O)Nc1ccccc1O 160953708 XEPBLRUETZIUDK-HNNXBMFYSA-N 277.364 3.459 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cccc(C)c1C 159733415 XTYBEBNJVCRFSS-UHFFFAOYSA-N 278.396 3.224 70 20 CGID CC[C@@H](C)C(=O)Nc1cc(F)ccc1OC(F)F 159395388 BAUZSMVKUTZOBL-SSDOTTSWSA-N 261.243 3.412 70 20 CGID CC[C@@H](NC(=O)Nc1cc(C)cc(C)c1)[C@H]1CCCO1 159398871 QUDNZIVYFUFTDS-HUUCEWRRSA-N 276.380 3.383 70 20 CGID Cc1nnc(-c2ccccc2C(=O)N(C)CC(C)(C)C)o1 161094645 GDKLIUKHYQBLBY-UHFFFAOYSA-N 287.363 3.163 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@H](C)Cc1cccc(Cl)c1 161150522 PBQGMWRXLGYZJF-IUODEOHRSA-N 297.826 3.042 70 20 CGID COc1cc(CCC(=O)Nc2ccccn2)ccc1Cl 161202394 JXPMLUSCGJTGGQ-UHFFFAOYSA-N 290.750 3.315 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)CCCOc1ccc(F)cc1 161439861 NFFATXYUWZSZAT-BETUJISGSA-N 279.355 3.384 70 20 CGID Cc1cccc([C@H](NC(=O)C2CCC2)c2ccccn2)c1 160057731 FZDXWWNWANXCEE-KRWDZBQOSA-N 280.371 3.396 70 20 CGID CCc1ccc([C@H](C)CC(=O)NCCN(C)C(C)C)cc1 160182767 VVBVTQRHNJYRAA-OAHLLOKOSA-N 290.451 3.199 70 20 CGID CC(C)(C)c1cnc([S@@](=O)C[C@H]2CCCCO2)s1 160453250 KETRRTGLQCXMAF-MLCYQJTMSA-N 287.450 3.117 70 20 CGID C[C@H](CCc1ccccc1F)NC[C@H]1CCCC[C@@H]1O 160547018 KXEKXHDTAASVAB-UNEWFSDZSA-N 279.399 3.288 70 20 CGID Cc1cccn2cc(CNC(=O)[C@@H](C)c3cccs3)nc12 159474391 LNBKLGFDEQVJNO-LBPRGKRZSA-N 299.399 3.124 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cc(F)ccc1C 159935632 HRLUJLKCTASUEP-UHFFFAOYSA-N 282.359 3.054 70 20 CGID NCC1(C(=O)N2CC3(CCCC3)c3ccccc32)CCCC1 159367715 VKIIUCHCCLTRKN-UHFFFAOYSA-N 298.430 3.364 70 20 CGID CC[C@@H](NC(=O)Nc1c(F)cccc1F)[C@@H]1CCCO1 159379932 MSZXMBNMIXTECK-NEPJUHHUSA-N 284.306 3.044 70 20 CGID C[C@H](SCCN1CCOCC1)c1cc(F)ccc1F 159996314 STYCTOHPSGDPDO-NSHDSACASA-N 287.375 3.091 70 20 CGID CC1(C)CC[C@H](COC(=O)c2c(N)cccc2Cl)O1 160788701 PCIJKGQGHZTLOX-SECBINFHSA-N 283.755 3.037 70 20 CGID Cc1cccc([C@H]2CCCN2CCCOC(C)C)n1 159779780 GJUPFSHPUVWLCB-MRXNPFEDSA-N 262.397 3.342 70 20 CGID Cc1ccc(C)c(-n2ncc(C(=O)N3CCCCC3)c2C)c1 161305013 RLCNKKICMMYWCX-UHFFFAOYSA-N 297.402 3.424 70 20 CGID CC[C@H](NC(=O)Cc1ccccc1F)c1c(C)noc1C 160016414 TWMLFBVNOCQHKL-AWEZNQCLSA-N 290.338 3.241 70 20 CGID C[C@H](Nc1ccc2oc(N(C)C)nc2c1)c1ccncc1 160026785 ZILDEBVVYLRHMC-NSHDSACASA-N 282.347 3.462 70 20 CGID O=C(NCC1(C2CC2)CC1)Nc1ccccc1-n1cccn1 160163959 BEFOTPHXBUQRRG-UHFFFAOYSA-N 296.374 3.184 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N1CCN(c2cccc(C)c2)CC1 160254437 IKCDWOVCOCOLMH-SJLPKXTDSA-N 286.419 3.080 70 20 CGID C[C@@H](C(=O)NCCc1cccs1)c1c(F)cccc1F 160547746 WMIMCJDLYMVWPX-SNVBAGLBSA-N 295.354 3.489 70 20 CGID CCC[C@H](N)C(=O)N[C@H](c1ccccc1Cl)C(C)C 160830263 JVBCHCFQKXSEEA-KBPBESRZSA-N 282.815 3.281 70 20 CGID CCOc1ccc([C@H](C)NCC2(CO)CCCC2)cc1 160096968 BRBQDXIMXXLKPL-AWEZNQCLSA-N 277.408 3.289 70 20 CGID CCC1(CNCc2ccccc2NC(C)=O)CCC1 160541385 KDNALDBJTOBMGQ-UHFFFAOYSA-N 260.381 3.315 70 20 CGID Cc1cc(N[C@@H]2CCOC(C)(C)C2)nc(C(C)C)n1 160632201 VJGTXKJSKVNUQD-GFCCVEGCSA-N 263.385 3.278 70 20 CGID OC[C@H](Cc1ccccc1)NCc1cc(F)cc(Cl)c1 160936318 HYDAFSAYCZNFFA-INIZCTEOSA-N 293.769 3.172 70 20 CGID Fc1cc(OCCOC[C@@H]2CCCO2)ccc1Cl 161113171 GWRIYHINLZRCJN-NSHDSACASA-N 274.719 3.054 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)[C@@H](C)n1nc(C)cc1C 161067916 DVODQKSUGBSQLJ-BZUAXINKSA-N 291.439 3.488 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@H]1CC1(Cl)Cl 160100602 YCVPZMRWZGPNQH-RKDXNWHRSA-N 290.215 3.436 70 20 CGID Cc1ccc2cccc(NC(=O)NOCC(C)C)c2n1 160110323 FOQMJLXCMSTIMR-UHFFFAOYSA-N 273.336 3.252 70 20 CGID C[C@H]1CC[C@@H](CC(=O)N(C)c2ccc3c(c2)OCO3)C1 160226980 UCWUWTYAQRLJRH-NWDGAFQWSA-N 275.348 3.204 70 20 CGID C[C@H](Cc1ccccc1F)C(=O)N(C)Cc1cccn1C 160655437 MUBCBQCDRBANHN-CYBMUJFWSA-N 288.366 3.001 70 20 CGID CC[C@@H](NCC(=O)NC1CCCC1)c1ccc(F)cc1F 160835483 KLTRCAUOJJVLSL-OAHLLOKOSA-N 296.361 3.064 70 20 CGID CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(CN)o1 159916438 FDIFNDJELQKBTL-CYBMUJFWSA-N 278.396 3.169 70 20 CGID Cc1cccc(C(=O)NC[C@@H](O)c2ccccc2)c1Cl 160378460 ATASXQYABUVIDV-CQSZACIVSA-N 289.762 3.112 70 20 CGID COc1ccc(NC(=O)c2ccnc(Cl)c2F)cc1 160709653 LUUNJWBZMRCIJB-UHFFFAOYSA-N 280.686 3.135 70 20 CGID CCOc1ccc(CNC(=O)N2CCCC[C@@H]2C)cc1 217300879 PNSSKTAHMBUCJA-ZDUSSCGKSA-N 276.380 3.169 70 20 CGID CN(Cc1ccc(OC(F)F)cc1)Cc1cncs1 160620426 PERHOLCNLXQBAR-UHFFFAOYSA-N 284.331 3.377 70 20 CGID C[C@@H](NC(=O)NC1CCCCC1)c1ccsc1 160525740 IBDAVBVBRXXHEW-SNVBAGLBSA-N 252.383 3.441 70 20 CGID COc1ccc([C@H](C)NC(=O)NCc2ccccc2)cc1 217278200 NAOCZJGARMSBDY-ZDUSSCGKSA-N 284.359 3.256 70 20 CGID CC(C)NCCC(=O)NC(C)(C)c1cccc(Cl)c1 161163030 GSOYFMDEYHFVHC-UHFFFAOYSA-N 282.815 3.079 70 20 CGID CCO[C@@H]1C[C@H](N[C@@H](C)c2cnccn2)C1(CC)CC 161301046 OYONRWVISDMMML-AEGPPILISA-N 277.412 3.111 70 20 CGID CN(CCc1ccccn1)C(=O)C(C)(C)C1CCCC1 161357720 QTMHDYSSRHUIPL-UHFFFAOYSA-N 274.408 3.299 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)CCCc1ccccn1 159802492 VQLTTWWIQYRDPM-ZFWWWQNUSA-N 260.381 3.099 70 20 CGID CCOCCC1(CNC(=O)C[C@@H](C)CC(C)C)CC1 159418975 GRDLFUVQJVZWPH-AWEZNQCLSA-N 269.429 3.382 70 20 CGID CC(C)[C@H]1OCC[C@@H]1CNc1nc(C(C)(C)C)ns1 159839218 IORAEQFRHMWXEW-GHMZBOCLSA-N 283.441 3.309 70 20 CGID CC1(Nc2ncnc3c2cnn3-c2ccccc2)CCC1 159902663 IZRGZCXHNILJAA-UHFFFAOYSA-N 279.347 3.170 70 20 CGID CC(C)N1CCC[C@@H](CNC(=O)C2CCC(C)(C)CC2)C1 159551048 ZRBVJNHBLCXATQ-HNNXBMFYSA-N 294.483 3.439 70 20 CGID CC[C@@H](C)[C@@H](O)CNC(=O)CCC(C)(C)c1ccccc1 159399674 PQWMXIFMFQZGQP-ZBFHGGJFSA-N 291.435 3.268 70 20 CGID CN(Cc1cccc2ccccc12)C[C@H]1CCC[C@@H]1O 159499579 IFQNXTVKQWBXQT-AEFFLSMTSA-N 269.388 3.433 70 20 CGID CC(C)c1ccccc1OS(=O)(=O)C[C@H]1CCCCO1 216882413 VONWXWFCUYJNKG-CYBMUJFWSA-N 298.404 3.088 70 20 CGID C[C@H](c1ccc(OC(F)(F)F)cc1)S(=O)(=O)Cl 309801396 JXRCAMGFUFZHJA-ZCFIWIBFSA-N 288.674 3.215 70 20 CGID Cc1noc(-c2cc(Cl)cc(Br)c2)n1 161341015 AUJCTZJEQMPALO-UHFFFAOYSA-N 273.517 3.461 70 20 CGID Cc1cccc(C)c1OCCCN[C@H]1CCN(C)[C@H](C)C1 161231797 HVZPOFDBODEVKB-SJORKVTESA-N 290.451 3.145 70 20 CGID C[C@@H](NC(=O)N[C@@H]1C=CCCC1)c1ccc(F)cc1F 161357977 RCEPHGXZIKVKFN-ZYHUDNBSSA-N 280.318 3.434 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCCOc2ccccc21 160124085 AJACHZJGYRVYPG-GOEBONIOSA-N 276.424 3.220 70 20 CGID C[C@@H](C(=O)N(C)c1ccc2c(c1)OCO2)c1cccs1 160153977 HZOBGMOVPUNUGW-SNVBAGLBSA-N 289.356 3.243 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cccs1 160658736 PTFNFBPGELWVFF-GFCCVEGCSA-N 279.405 3.360 70 20 CGID CC[C@H](N[C@H](CN1CCCC1=O)c1ccccc1)C1CC1 160772472 ZPBDHNKZSDDLTN-DLBZAZTESA-N 286.419 3.128 70 20 CGID CCCCn1ncc(C(=O)NCc2cccc(C)c2)c1C 160849858 BKKSPGQODLWYDX-UHFFFAOYSA-N 285.391 3.230 70 20 CGID O=C(Nc1cc(F)ccc1F)N[C@H]1CCO[C@@H](C2CC2)C1 160990484 LLUQFRKRPVOGOI-SMDDNHRTSA-N 296.317 3.044 70 20 CGID COc1ccc(NC(=O)N(C)c2c(C)noc2C)c(C)c1 159681352 YIIHZEUXJBTWCF-UHFFFAOYSA-N 289.335 3.277 70 20 CGID CC(C)c1noc([C@H](C)N(C)OCc2ccccc2)n1 159590237 HFWMLOHKLGHGOU-LBPRGKRZSA-N 275.352 3.318 70 20 CGID Cn1cnnc1CN(Cc1ccccc1)Cc1ccccc1 160670688 GFFKWXYVUAMCKJ-UHFFFAOYSA-N 292.386 3.018 70 20 CGID CCOc1ccc([C@H](C)N[C@H]2CCN3CCCC[C@@H]23)cc1 217657995 MGUYTXXAPVGMMA-WBAXXEDZSA-N 288.435 3.363 70 20 CGID COc1cc(NCCCNC(=O)OC(C)(C)C)ccc1F 160047983 FXNPHTVWEZEYNY-UHFFFAOYSA-N 298.358 3.161 70 20 CGID CCc1ccccc1CNc1ncnc(CC)c1F 218035344 QFMQIYUQFVPVBE-UHFFFAOYSA-N 259.328 3.353 70 20 CGID C[C@H]1CCC[C@H](CNCc2nc3ccccc3n2C)C1 218133914 RYJVBHJIKYGBKJ-KBPBESRZSA-N 271.408 3.489 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)[C@H]2C[C@@H]2C2CC2)o1 161207257 IDEWMSKZSOZRCB-QLFBSQMISA-N 289.375 3.136 70 20 CGID COc1ccc(C)nc1NC(=O)N1CCCC[C@@H]1C(C)C 160459395 OOWWUSDZGRJFSP-CYBMUJFWSA-N 291.395 3.441 70 20 CGID C[C@H](CCc1ccc(F)cc1)NC[C@H]1CCCC[C@@H]1O 160643987 OAAGZBARIOUCFM-UNEWFSDZSA-N 279.399 3.288 70 20 CGID CC(C)CCNC(=O)N1CCC[C@@H](Nc2ccccc2)C1 160645163 CZKPODODGGADCO-MRXNPFEDSA-N 289.423 3.319 70 20 CGID O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)NCC1(C2CC2)CC1 160728028 UHIKYQWYQFOKPD-GVDBMIGSSA-N 296.414 3.062 70 20 CGID Cc1ccc(C(=O)N[C@H](C)CC(=O)c2cccs2)o1 160914917 WEVXZKGWKNQUAQ-SECBINFHSA-N 277.345 3.041 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](C)c2cnn(C)c2)C1 159407828 PWVKXXAVUWFKHC-FPMFFAJLSA-N 267.442 3.135 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCC1(C2CC2)CC1 159855721 XGJYUTKOHYAAIW-STQMWFEESA-N 275.417 3.466 70 20 CGID CCC(CC)(CC)CNC(=O)NCc1ccc(O)cc1 159679120 ICBYVCVZIWCXFX-UHFFFAOYSA-N 278.396 3.408 70 20 CGID CC[C@@H](CC(=O)Nc1cccn(C)c1=O)c1ccc(C)cc1 159918468 BPWAUMRSROHFAX-AWEZNQCLSA-N 298.386 3.216 70 20 CGID COc1ccc(N(C)C(=O)Cc2ccccc2F)cc1F 159547979 LLBALXFNTCREII-UHFFFAOYSA-N 291.297 3.179 70 20 CGID O=C(Nc1cccc2c1CCCC2)[C@@H]1CCCCO1 159553648 AORFKZPSWNXCFZ-HNNXBMFYSA-N 259.349 3.073 70 20 CGID Cc1nccc(NC(=O)N2[C@H](C)CC[C@H]2C)c1Cl 159758333 WHPMWEKRAYZPAN-RKDXNWHRSA-N 267.760 3.448 70 20 CGID O=C(NCc1cccc(F)c1)c1cc(F)cc2cccnc12 159382580 HSMHXPPZGFZOPJ-UHFFFAOYSA-N 298.292 3.443 70 20 CGID COc1ccc(N(C)C(=O)CCC2CCC2)cc1F 159385973 WWZKYCBMSAMIRQ-UHFFFAOYSA-N 265.328 3.377 70 20 CGID CN(Cc1cccc(Cl)c1)Cc1cncs1 161127809 UQDHWRCJTIBYFF-UHFFFAOYSA-N 252.770 3.429 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCc1ccc(F)cc1 217270195 ZCVFKPUZAOBJPV-CQSZACIVSA-N 264.344 3.300 70 20 CGID CCOc1cccc(NC(=O)N[C@H](CC)[C@H]2CCCO2)c1 161417194 MCQRDZSSBIAIQS-HUUCEWRRSA-N 292.379 3.164 70 20 CGID CCOCCC1(CNC(=O)NCC2(C3CC3)CCC2)CC1 161466009 NWYHKXGKONMSDH-UHFFFAOYSA-N 294.439 3.073 70 20 CGID CO[C@H](C(=O)Nc1ccccc1N(C)C)c1ccccc1 161492694 VKSMOKWTNLGVQG-INIZCTEOSA-N 284.359 3.079 70 20 CGID O=C([C@H]1CCCCO1)N1CCCSc2ccccc21 160033152 GEBYZAKCBALCKJ-CYBMUJFWSA-N 277.389 3.085 70 20 CGID CSC[C@H](CCO)N[C@H](C)c1cc(C)sc1C 160181399 DASFUPJPJNDKJS-PWSUYJOCSA-N 273.467 3.130 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)N(C)Cc1ccncc1 160336883 UESBNHFAJDBONE-UONOGXRCSA-N 286.400 3.214 70 20 CGID CCS[C@@H]1CCCCN(Cc2cnc3ccccn23)C1 160363853 LRKBWBRAFWGWAK-OAHLLOKOSA-N 289.448 3.442 70 20 CGID COc1ccc(C)cc1NC(=O)N[C@@H]1CCOC(C)(C)C1 160847675 CVXVEVWSVYVVOK-GFCCVEGCSA-N 292.379 3.083 70 20 CGID CCC(CC)NC(=O)c1ccnn1C(CC)CC 160887502 LZLVQUBIQDYAOZ-UHFFFAOYSA-N 251.374 3.163 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cccc(NC(C)=O)c1C 160925633 VOFBDUAODMTROE-BLLLJJGKSA-N 274.364 3.328 70 20 CGID O=C(NCc1ccccc1)c1ccccc1OCC(F)F 159526042 DUGXXAXYXQLPPK-UHFFFAOYSA-N 291.297 3.261 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1ccnc(SC)c1 159761314 DVYJVXHTENUJMQ-ZYHUDNBSSA-N 264.394 3.112 70 20 CGID Cc1ccc(CNC(=O)C(C)(C)F)c(OCC2CC2)c1 159374722 WWUZRVUCNZJBBY-UHFFFAOYSA-N 279.355 3.148 70 20 CGID CC(C)(C)C[C@H](CO)Nc1ccnc2ccccc12 161466635 BIUGXSWWYHUZPV-GFCCVEGCSA-N 258.365 3.444 70 20 CGID C[C@H](CN[C@H](C)C1(C)CC1)N(C)Cc1ccccc1 160884138 BHLILOHZNXTQLV-HUUCEWRRSA-N 260.425 3.285 70 20 CGID CN(Cc1cncs1)Cc1ccccc1Cl 160816353 LLIYSWDMTOOAKA-UHFFFAOYSA-N 252.770 3.429 70 20 CGID C1=C(CN2CCC(c3nc4ccccc4o3)CC2)COCC1 161065246 WTQDMNKZAFKLSW-UHFFFAOYSA-N 298.386 3.354 70 20 CGID CC[C@@H](NC(=O)c1cc(F)cc(F)c1)c1c(C)noc1C 160275291 SVPPIZKHLSUVAS-CYBMUJFWSA-N 294.301 3.451 70 20 CGID CC(C)(C)CC(=O)N[C@@H]1CCOC2(CCCCC2)C1 160279054 YMJSFRWOZLHPAA-CYBMUJFWSA-N 267.413 3.421 70 20 CGID CN(C(=O)CC1CCCCC1)c1ccc2c(c1)OCO2 160356274 DPFMPLWWEMPSLH-UHFFFAOYSA-N 275.348 3.349 70 20 CGID CC1(C)CCCC[C@@H]1CC(=O)N1CCOc2ncccc21 160928206 CJGGJBMRMHDQCJ-CYBMUJFWSA-N 288.391 3.414 70 20 CGID CCSCc1cccc(NC(=O)Nc2ccn(C)n2)c1 160982928 PVJILQBCFPALJU-UHFFFAOYSA-N 290.392 3.317 70 20 CGID CN(C)[C@@H](CNCc1cc(F)cc(Cl)c1)c1ccco1 160812341 XVQHQPKFVPSBTB-AWEZNQCLSA-N 296.773 3.465 70 20 CGID CCCCCCCOCCCCS(=O)(=O)Cl 114257877 OWPRNTJAPCXHPC-UHFFFAOYSA-N 270.822 3.322 70 20 CGID C[C@@H]1CCC[C@](CN[C@H](C)c2cscn2)(N(C)C)C1 218232619 IYTSANPQXFTSAU-NFAWXSAZSA-N 281.469 3.304 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C)nc1 161231880 CYSNLSVTLVSGKQ-DZGCQCFKSA-N 260.381 3.431 70 20 CGID CCN(C(=O)Cc1ccc(F)cc1Cl)c1ccncc1 161071020 UTHAKKBYLIJXEX-UHFFFAOYSA-N 292.741 3.470 70 20 CGID CS[C@H](C)CC(=O)Nc1cc(Cl)ccc1N(C)C 161247343 CIAILMHHFAPNON-SECBINFHSA-N 286.828 3.486 70 20 CGID CCCCOc1ncccc1CNC(=O)NC1(C)CCC1 160039033 HZPVFIWFMKGGGN-UHFFFAOYSA-N 291.395 3.002 70 20 CGID CC[C@@H](NC(=O)c1cccc(F)c1)c1c(C)noc1C 160160975 TUEHZEKYQHRPQM-CYBMUJFWSA-N 276.311 3.312 70 20 CGID C[C@H](NCCOc1cccc(Cl)c1)C1CCOCC1 160264228 VUSLTZPYWPSPIP-LBPRGKRZSA-N 283.799 3.124 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(-c2cnco2)cc1 160281822 HMHMKMMVSFQOLM-JTQLQIEISA-N 276.361 3.422 70 20 CGID CC(C)N(C)c1cccc(NC(=O)NC2CC=CC2)c1 160459053 FAZMVALBVDRNAT-UHFFFAOYSA-N 273.380 3.371 70 20 CGID CN(Cc1ncc(-c2ccccc2F)o1)CC(F)F 160557176 BIMWQFKKJPPJPB-UHFFFAOYSA-N 270.254 3.178 70 20 CGID C[C@@H]1C[C@@H](N(C)C(=O)C2CCC(C)(C)CC2)CCN1C 160658501 MUSNNEZPNJRIOZ-HIFRSBDPSA-N 280.456 3.144 70 20 CGID CC(C)C[C@@H]1CCN(C(=O)C[C@H](C)c2ccncc2)C1 160949585 FRNLLAQOENMMKJ-GJZGRUSLSA-N 274.408 3.470 70 20 CGID Cc1ccccc1[C@@H](CC(C)C)NC(=O)[C@@H](N)C(C)C 159694881 VDQSLSZIXTUOHB-CVEARBPZSA-N 276.424 3.182 70 20 CGID CC[C@H](C)c1cc(C(=O)Nc2ccc3c[nH]nc3c2)on1 159768240 XXKAAQAGMKCLBD-VIFPVBQESA-N 284.319 3.317 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(F)c(F)c2)cc1F 159398028 CCJBSRAHCIELOR-UHFFFAOYSA-N 295.260 3.389 70 20 CGID CC[C@H]1CCCC[C@@H]1NCc1ccc(N(C)C)nc1 159852119 IDJSBQKXACYLBQ-GJZGRUSLSA-N 261.413 3.206 70 20 CGID CCSCC[C@@H](C)NCc1cnc2ccccc2n1 160069041 VXTFPKIYBOIUSH-GFCCVEGCSA-N 275.421 3.251 70 20 CGID CCC[C@H]1CCCN(C(=O)c2csc(NCC)n2)C1 160374992 SGXWLOTXHONUDO-NSHDSACASA-N 281.425 3.227 70 20 CGID CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NCC1CCN(C)CC1 217485842 CSMAIFYSZRTRIL-OIISXLGYSA-N 266.473 3.379 70 20 CGID COCC[C@H](C)N[C@H](c1ccc2c(c1)OCCO2)C(C)C 161037871 BMYMPXSYWXMLRJ-GUYCJALGSA-N 293.407 3.170 70 20 CGID CC(C)C[C@H](C)N(C)C(=O)COc1ccc2[nH]ccc2c1 160025130 CZZIMKUBPDPEMS-ZDUSSCGKSA-N 288.391 3.440 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)cc1F 160196356 WRBSBDKSFKIJKI-AWEZNQCLSA-N 291.366 3.356 70 20 CGID CC[C@@H](C(=O)N[C@@H](C)CSC)c1ccc(F)cc1 160205170 YOCHNAWNVOZYBO-GXFFZTMASA-N 269.385 3.187 70 20 CGID Cc1ccc(C(=O)NC2CC2)cc1NCc1cccnc1C 160261061 UPJCLUCZVABRMI-UHFFFAOYSA-N 295.386 3.203 70 20 CGID COCCC1(CNC(=O)N[C@@H](C)CC(C)C)CCCC1 160366577 NBQYZWOXSITEJY-AWEZNQCLSA-N 284.444 3.317 70 20 CGID Cc1ccc(F)c(C(=O)N(C)c2ccc3c(c2)OCO3)c1 160628012 BORZBJWZOOJNGC-UHFFFAOYSA-N 287.290 3.139 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@H]2CCCCN2CC)c1 160755055 LYDKPUBPYRIDDS-OAHLLOKOSA-N 288.391 3.092 70 20 CGID CC(C)CSCCCNC(=O)C(C1CC1)C1CC1 160755693 XBKDCDXLIDVXGD-UHFFFAOYSA-N 269.454 3.318 70 20 CGID CC[C@@H](NC(=O)NC1(C)CCC1)c1nc(C)cs1 160853016 LPUVQUISMBDYIE-SNVBAGLBSA-N 267.398 3.144 70 20 CGID O=C(CC1CCC1)NCCOc1ccccc1Cl 159469913 VKUVJXAKDXTDOE-UHFFFAOYSA-N 267.756 3.025 70 20 CGID CC1(C)C[C@H](NCc2cccc3cc[nH]c23)CCO1 160438312 YBZPXYMORAXGKA-CQSZACIVSA-N 258.365 3.215 70 20 CGID Cn1cnnc1CSCc1cccc2ccccc12 161042246 CAWNTXUGAZMLQX-UHFFFAOYSA-N 269.373 3.402 70 20 CGID CCc1noc(C)c1C[S@](=O)c1ccc2c(c1)CCC2 161052577 NBGHLNIVPPKRAS-HXUWFJFHSA-N 289.400 3.342 70 20 CGID CCOc1ccc(Cl)cc1CCN[C@H](C)CCOC 160006197 AAYJCTWXRBGYFY-GFCCVEGCSA-N 285.815 3.296 70 20 CGID CC[C@H](N[C@@H](CCO)CSC)c1ccc(F)cc1F 160287750 KQWMXDZEFGJFAN-FZMZJTMJSA-N 289.391 3.120 70 20 CGID CCOC[C@H]1CCN(C(=O)CC2CCC(C)(C)CC2)C1 160400210 VBMFBVXTHFAOJF-HNNXBMFYSA-N 281.440 3.478 70 20 CGID CCC(N)(CC)CNC(=O)CCCCCc1cccs1 160439300 VJMLRXJFDIYHDC-UHFFFAOYSA-N 296.480 3.485 70 20 CGID CC(C)(C)c1cnc([S@@](=O)C[C@@H]2CCCCO2)s1 160452997 KETRRTGLQCXMAF-XTZNXHDOSA-N 287.450 3.117 70 20 CGID CCc1nc(C)c([C@H](C)NC[C@H]2CCCC[C@@H]2O)s1 160462695 XWGLBMQWZJFZOP-UHTWSYAYSA-N 282.453 3.216 70 20 CGID CCN(CC)CC(=O)N1CCC[C@@H]1c1cc(C)ccc1C 160686939 YGGPRYOYHGIRGG-QGZVFWFLSA-N 288.435 3.309 70 20 CGID CC(C)[C@@H](C(=O)N(C)Cc1cccn1C)c1ccccc1 160734512 BJHSGRGPIWFOQM-QGZVFWFLSA-N 284.403 3.423 70 20 CGID CC(C)C[C@H](CO)NC(=O)CCCc1ccc(Cl)cc1 160826588 PDKQYJIQQOVSBV-OAHLLOKOSA-N 297.826 3.186 70 20 CGID CC(C)CSCCCn1cnc(C(C)C)cc1=O 160925454 ABSGYSMIPIVAGC-UHFFFAOYSA-N 268.426 3.146 70 20 CGID CN(C)Cc1ccc(C(=O)N[C@@H]2CCCc3occc32)cc1 159635692 DBHDNJFJEOOLJO-MRXNPFEDSA-N 298.386 3.149 70 20 CGID CC[C@H](c1ccc(F)cc1)N(C)C[C@@H]1CCC[C@@H]1O 159644838 NIBGIYZBMQRZQU-IMJJTQAJSA-N 265.372 3.370 70 20 CGID CCS[C@@H]1CCCC[C@H]1NC(=O)NC[C@@H](C)SC 159491462 QFQDSWVIQRZLJF-IJLUTSLNSA-N 290.498 3.101 70 20 CGID O=C(Nc1cccc2c1CCCC2)[C@H]1CCCCO1 159553805 AORFKZPSWNXCFZ-OAHLLOKOSA-N 259.349 3.073 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1ccnc(SC)c1 159761065 DVYJVXHTENUJMQ-PWSUYJOCSA-N 264.394 3.112 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)NC(C)(C)C 159988467 KCYVKDCQKXSRHG-SNVBAGLBSA-N 284.425 3.082 70 20 CGID C[C@@H]1CC=CC[C@@H]1COC(=O)c1ccc2c(c1)CCC(=O)N2 216788757 BKFDKSGKPIRPEP-IUODEOHRSA-N 299.370 3.330 70 20 CGID Cc1ccc(NC(=O)c2nn(-c3ccccc3)cc2O)cc1 216916936 PSAJODGKTDDTBU-UHFFFAOYSA-N 293.326 3.139 70 20 CGID CN(Cc1ccc2cn[nH]c2c1)Cc1ccccc1F 160726058 QXMHACYMMHDVMP-UHFFFAOYSA-N 269.323 3.334 70 20 CGID Cc1cc(C)cc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1 161010423 IDLRQBPKGWRZHC-GDBMZVCRSA-N 288.391 3.383 70 20 CGID CC[C@@H](C)[C@@H](C)N(C(=O)NCC1(CCOC)CC1)C1CC1 161147436 OTYQMACHWQJJRG-ZIAGYGMSSA-N 296.455 3.412 70 20 CGID Cc1ccsc1-c1nnc(SCc2ccnn2C)o1 161375858 FGLWKEURLWIBBT-UHFFFAOYSA-N 292.389 3.132 70 20 CGID COc1ccc(OCCCC(=O)N2[C@H](C)CC[C@H]2C)cc1 161442134 NUQWKVVKUDNSRP-ZIAGYGMSSA-N 291.391 3.254 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc2c(c1)NC(=O)CS2 160184099 OMEOLZUGFIQAIK-ZUZCIYMTSA-N 290.388 3.106 70 20 CGID CC(C)CC1(C(=O)N(C)Cc2cccn2C)CCC1 160833694 ZJIPPLJPAFMGNH-UHFFFAOYSA-N 262.397 3.200 70 20 CGID Cc1ccc(OCCC(=O)NCC2(C3CC3)CC2)c(C)c1 159820657 CMNKHZTWYIGCQS-UHFFFAOYSA-N 287.403 3.379 70 20 CGID CCCn1ccc2ccc(NC(=O)C[C@@H]3CCCN3)cc21 159853968 PHQVGSCIUSTGAY-AWEZNQCLSA-N 285.391 3.132 70 20 CGID OCCN[C@H](Cc1ccc(Cl)cc1)c1ccccc1 159709477 QLVYREVPDVNWIF-MRXNPFEDSA-N 275.779 3.206 70 20 CGID CCc1ccc(NC(=O)NCC(CC)(CC)CO)cc1 159940826 GEUBLSPROWHNIZ-UHFFFAOYSA-N 278.396 3.169 70 20 CGID COCC[C@H](C)N[C@@H]1CCCc2cc(F)ccc21 159553270 LEXDIIYUYZRMOT-XHDPSFHLSA-N 251.345 3.218 70 20 CGID CC(C)N(Cc1cnc2cnccn12)C1CCCCC1 159768259 VKASEKZHRJESBU-UHFFFAOYSA-N 272.396 3.272 70 20 CGID CCCc1nnc(Sc2nc(C(C)(C)C)ns2)o1 159997814 MHEUKEHGHASHIJ-UHFFFAOYSA-N 284.410 3.322 70 20 CGID CCN(C)C[C@@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160829104 REPUKGUPHWKNPY-AWEZNQCLSA-N 280.456 3.003 70 20 CGID COC[C@@H](C)NC(=S)NCCCCCCC(C)C 217763916 HZUZITNAFJCZKY-CYBMUJFWSA-N 274.474 3.092 70 20 CGID CCCn1c(C)nnc1COc1ccc(Cl)c(F)c1 161441575 SIYVEGJPJLOBRP-UHFFFAOYSA-N 283.734 3.368 70 20 CGID CCC1(CC)[C@@H](N[C@@H](C)c2ccncc2)C[C@H]1OC 160102467 CKXOETHGQDDVAP-AEGPPILISA-N 262.397 3.326 70 20 CGID Cc1noc(C)c1CCSCc1noc(C2CC2)n1 160149725 BQEWHTXDWAWJFD-UHFFFAOYSA-N 279.365 3.028 70 20 CGID CSC[C@H](C)C(=O)N[C@H]1CCCc2sccc21 160190774 ZYFRFZMXAIQQLU-ONGXEEELSA-N 269.435 3.241 70 20 CGID CC1(NC(=O)NCc2cccc(OCC(F)F)c2)CCC1 160528779 MJHGAIWHSMWKNX-UHFFFAOYSA-N 298.333 3.072 70 20 CGID C[C@@H](c1nc([C@@H]2CCOC2)no1)c1c(F)cccc1F 160888740 PUMGLZKWTWVOFZ-RKDXNWHRSA-N 280.274 3.004 70 20 CGID COCC(=O)O[C@H](C)c1ccc(F)c(C(F)(F)F)c1 159468275 ZBLFLRSQCVXJFB-SSDOTTSWSA-N 280.217 3.095 70 20 CGID CCc1noc(C)c1CSCc1ccc(C(N)=O)cc1 159668610 GPRNCXQAOSXXKK-UHFFFAOYSA-N 290.388 3.078 70 20 CGID Cc1ccccc1CCCN(C)C[C@@H]1CCC[C@@H]1O 159552666 CWHDWJHRDVDHIW-IRXDYDNUSA-N 261.409 3.020 70 20 CGID Fc1ccc(CCNC(=S)Nc2ccccc2)c(F)c1 217380801 LPSPSEYPSFLUER-UHFFFAOYSA-N 292.354 3.494 70 20 CGID CC1(C)C[C@H](NC(=O)Nc2ccc3c(c2)CCC3)CCO1 161020495 IAFWCEVXUOMVSK-OAHLLOKOSA-N 288.391 3.254 70 20 CGID Cc1ccc(F)c(OCC(=O)N[C@@H]2CCc3ccccc32)c1 160306960 BJVUDTGCPIVOKF-MRXNPFEDSA-N 299.345 3.317 70 20 CGID CC(C)c1nccc(Oc2ccc3cn[nH]c3c2)n1 160403677 WMWXWCQQWPTQSB-UHFFFAOYSA-N 254.293 3.269 70 20 CGID CCOC[C@H](C)NCCOc1cccc(C(F)(F)F)c1 160496091 PAAJLFDTDRYNSS-NSHDSACASA-N 291.313 3.099 70 20 CGID CC(C)C1CCC(CNC(=O)Nc2cccnn2)CC1 160525495 DRMJUCTYLBEZCA-UHFFFAOYSA-N 276.384 3.061 70 20 CGID C[C@@H]1CC[C@@H](CC(=O)Nc2ccnn2C(C)(C)C)C1 160581849 ZFQNSPMAVSXGOK-VXGBXAGGSA-N 263.385 3.403 70 20 CGID COC[C@H](NC(=O)Nc1cccc(C)c1Cl)C1CC1 160717704 HTPAUMPPUBFNOF-LBPRGKRZSA-N 282.771 3.195 70 20 CGID CCCCN(CCCC)C(=O)N[C@@H]1CCN(CC2CC2)C1 160741056 KWXAVPBEGFHJBJ-MRXNPFEDSA-N 295.471 3.083 70 20 CGID O=C(CC1=CCCCC1)N[C@H]1CCOC2(CCCC2)C1 159429332 RERHRYDQUKFYCT-HNNXBMFYSA-N 277.408 3.485 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@@H](C)C1CCC1 159543216 OIIACUXQOHUBPT-JTQLQIEISA-N 250.317 3.444 70 20 CGID CN(C)[C@H]1CCC[C@H](Nc2nc(C(C)(C)C)ns2)C1 159842100 LHCVIWDVQPDUCX-QWRGUYRKSA-N 282.457 3.120 70 20 CGID CCc1cc(O)nc(CN(C)Cc2cccc(Cl)c2)n1 160531561 QFUZLJYIBJSJNU-UHFFFAOYSA-N 291.782 3.030 70 20 CGID CC(C)C[C@H](CO)NC(=O)c1cc2ccc(F)cc2s1 161191126 IORUKLUQTBUBEC-GFCCVEGCSA-N 295.379 3.177 70 20 CGID COC(=O)CCCN1CCC[C@@H]1Cc1ccccc1Cl 217223734 JUTFOXNJCPJYDA-CQSZACIVSA-N 295.810 3.300 70 20 CGID COC(=O)N1CCC(c2cccc(Br)c2)CC1 217258179 MGYFWELESNKKOF-UHFFFAOYSA-N 298.180 3.395 70 20 CGID CC[C@H]1CCCCN1C(=O)c1cc(OC)c(OC)cc1F 161121509 QWUCUXLEDHBTRE-NSHDSACASA-N 295.354 3.248 70 20 CGID CC[C@H](C)Oc1ccc(C(=O)N[C@H](CO)CC(C)C)cc1 161231813 VGPBAJJJSKCBED-ZFWWWQNUSA-N 293.407 3.001 70 20 CGID C[C@@H](Sc1nnc(-c2ccco2)n1C)C(F)(F)F 161496051 SUSWFUAJFPSFIU-ZCFIWIBFSA-N 277.271 3.118 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)CCOC(C)C 160200118 WDUNARKEZDUWBG-ZDUSSCGKSA-N 280.364 3.423 70 20 CGID CC(C)N(C(=O)c1cccnc1Br)C(C)C 160430943 VUGOSIWOAKNZFB-UHFFFAOYSA-N 285.185 3.103 70 20 CGID C[C@@H](NCC1(Sc2ccccc2)CC1)[C@H]1CCOC1 160479719 CZGAEOFOKMGWSO-KGLIPLIRSA-N 277.433 3.326 70 20 CGID CC[C@H](C)Oc1cc(C(=O)Nc2cccc(F)n2)ccn1 160574841 YECWFCRJVRKZSE-JTQLQIEISA-N 289.310 3.045 70 20 CGID CSc1ccc(C)c(C(=O)N(C)Cc2cccn2C)c1 160774281 FWRYTOAJCMMREZ-UHFFFAOYSA-N 288.416 3.328 70 20 CGID CC[C@H]1CN(C(=O)CCCc2sccc2C)CCO1 160822753 RQDRCZORIVMPLU-ZDUSSCGKSA-N 281.421 3.017 70 20 CGID CCN(CC)c1ccc(NC(=O)C[C@H](C)SC)cn1 159601778 ISANHTHBPIGNIQ-NSHDSACASA-N 281.425 3.008 70 20 CGID CCC(C)(C)C(=O)NCCc1cc2ccccc2[nH]1 159612440 MNEJHKWSWMUHFA-UHFFFAOYSA-N 258.365 3.263 70 20 CGID C[C@H]1C[C@@H]1c1ccc(CN(CCn2ccnc2)C2CC2)o1 159695376 VKZMAZBHIJVYDV-BBRMVZONSA-N 285.391 3.264 70 20 CGID COCCCCC(=O)N[C@@H]1CCCc2sccc21 159901948 IVEAKPUOBUZVRT-GFCCVEGCSA-N 267.394 3.058 70 20 CGID CC[C@H](NC(=O)Nc1ccc(F)cc1C)[C@H]1CCCO1 159542000 JEZQQAIUVIMQPJ-GXTWGEPZSA-N 280.343 3.213 70 20 CGID CC(C)N(Cc1ccc(C(=O)N(C)C)[nH]1)C1CCCCC1 159768402 BYOZEBONBLLOBX-UHFFFAOYSA-N 291.439 3.260 70 20 CGID Cc1ccsc1CN[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 159580787 XTAPOQGAOIEESW-UBHSHLNASA-N 263.406 3.104 70 20 CGID CCc1noc(C)c1CSCC(=O)N1CCC(C)CC1 159986325 QPNDPSXUVCCHQH-UHFFFAOYSA-N 296.436 3.037 70 20 CGID CC(C)(C)CCNC(=O)c1sc2ncccc2c1N 159449874 KLFSHHRYPQAFNF-UHFFFAOYSA-N 277.393 3.045 70 20 CGID CCSCC[C@H](C)NC[C@H](O)c1ccc(F)c(F)c1 160127184 DLUGSWBGKZGCKZ-HZMBPMFUSA-N 289.391 3.120 70 20 CGID Cc1ccc([C@@H](C)NCc2cnn(C)c2C)cc1C 161311957 HMMJTNGWEWYCQK-CYBMUJFWSA-N 257.381 3.196 70 20 CGID CN1CCC(N(C)C(=O)Nc2c(F)cccc2Cl)CC1 217313070 BSHHGVGDMOHJHC-UHFFFAOYSA-N 299.777 3.037 70 20 CGID C[C@H](N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccco1 160203274 JYMNWOUKGRPDQF-VYDXJSESSA-N 284.403 3.451 70 20 CGID CC[C@H](C(=O)N[C@@H](CC)[C@@H]1CCCO1)c1ccc(F)cc1 161394909 YGPFBRCMDNSKED-JYJNAYRXSA-N 293.382 3.393 70 20 CGID CN1CCC(N[C@@H]2CCC[C@H]2c2ccccc2)CC1 161461494 ZXBFZSYTKRWLQW-DLBZAZTESA-N 258.409 3.007 70 20 CGID CC(C)c1cc(C(=O)N[C@@H]2CCCc3sccc32)n[nH]1 160050572 WELZWXKLINKYOL-LLVKDONJSA-N 289.404 3.402 70 20 CGID CCc1nc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)n[nH]1 160271148 GUFIDGLSSSIHBJ-VIFPVBQESA-N 298.312 3.237 70 20 CGID CC[C@@H](C)c1cc(C(=O)N2CCC[C@H]2c2ccc[nH]2)on1 160312838 CYRHQZALESESOP-RISCZKNCSA-N 287.363 3.494 70 20 CGID CSCc1cccc(NC(=O)NC2CC=CC2)c1 160463613 ZOQWSLMAVZUOEA-UHFFFAOYSA-N 262.378 3.390 70 20 CGID C[C@@H](CCc1cccc(F)c1)NC[C@H]1CCCC[C@@H]1O 160536931 OWMDJWIPHWXERU-LXZKKBNFSA-N 279.399 3.288 70 20 CGID CC[C@@H](C(=O)Nc1ccc(F)cn1)c1ccc(F)cc1 159759176 DNFUUWOIOBSRLM-CYBMUJFWSA-N 276.286 3.492 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2cccc(Cl)c2N)O1 160792816 MUBRNYQZMXFECS-VIFPVBQESA-N 283.755 3.037 70 20 CGID CN(C)[C@@H]1CCC[C@H](N[C@@H]2CCc3cc(F)ccc32)C1 161002899 VXGODTAGULUNAT-ZMSDIMECSA-N 276.399 3.275 70 20 CGID Cc1ccc([C@@H](C)N(C)C(=O)[C@H]2CCCCO2)cc1 161118254 BJDFCLZJEQJLMX-UKRRQHHQSA-N 261.365 3.084 70 20 CGID CC1=C(C(=O)NCC2(c3ccccc3)CCC2)CCCO1 161308482 QORPVUFPHRMQSW-UHFFFAOYSA-N 285.387 3.309 70 20 CGID C[C@H](C(=O)N[C@H]1CCc2c(O)cccc21)c1ccsc1 160236113 IOHKEAHNFZMWKJ-HZMBPMFUSA-N 287.384 3.361 70 20 CGID CSCC[C@H](C)N(C)C(=O)C[C@H](C)c1ccncc1 160711616 GJWCAHWORXDEPI-STQMWFEESA-N 280.437 3.175 70 20 CGID COCCC1(C(=O)NCCCSCC(C)C)CCC1 160800497 YQADITQOPNUTRH-UHFFFAOYSA-N 287.469 3.089 70 20 CGID CC[C@@H](N[C@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1F 160928278 OTYCPFVNTOXFEB-CABCVRRESA-N 296.361 3.015 70 20 CGID CCCC[C@@H](NC(=O)NCCc1cscn1)C1CCC1 159426160 WWEZVACVVRUGQB-CQSZACIVSA-N 295.452 3.344 70 20 CGID CC[C@@H](C(=O)NCCCCCOC)c1ccc(F)cc1 159531000 DBBANDQTVUIKLM-OAHLLOKOSA-N 281.371 3.252 70 20 CGID CCOc1ccccc1[C@H](C)NCC1(CO)CCCC1 160069243 CKQKGUGLRXYWSJ-AWEZNQCLSA-N 277.408 3.289 70 20 CGID Cc1ccc(Cl)cc1C(=O)Nc1cccc(CO)c1 160376315 OTIZHRAPTCHEIY-UHFFFAOYSA-N 275.735 3.393 70 20 CGID CCOc1ccc(CN[C@H]2CCOC(C)(C)C2)cc1 160443230 AHOVRNWTPCHUQI-AWEZNQCLSA-N 263.381 3.133 70 20 CGID COc1ccccc1[C@@H](C)N[C@@H]1CCC[C@H](N(C)C)C1 161055241 ARSNRRJLBKMKHQ-KFWWJZLASA-N 276.424 3.219 70 20 CGID COC(=O)C1(NCc2cc(C)ccc2C)CCCCC1 217096994 WSBZSZZQRKNDGT-UHFFFAOYSA-N 275.392 3.269 70 20 CGID CCCCCc1nc2ccccc2n1CCS(=O)(=O)F 883953300 PQSBVDMOWPBYCI-UHFFFAOYSA-N 298.383 3.068 70 20 CGID CC[C@@H](C)c1ccc(OCC(=O)N2CCCC2)cc1 217347699 QCUYDKHDMFSIAB-CYBMUJFWSA-N 261.365 3.201 70 20 CGID CCCN(CCO)Cc1cc(F)cc(C(F)(F)F)c1 161220975 YGQXDIGHYJEKIR-UHFFFAOYSA-N 279.277 3.049 70 20 CGID CCC[C@H](CC)NC(=O)Nc1cc(C(=O)OC)cs1 161059944 HDNODOHCNFYHLB-JTQLQIEISA-N 284.381 3.235 70 20 CGID C[C@H]1[C@@H](C)Sc2ccccc2N1CC[C@@H]1CCOC1=O 161161834 KKEQVRQZBSPNLN-YNEHKIRRSA-N 291.416 3.329 70 20 CGID COc1ccc(NC(=O)C[C@H]2CCc3ccccc32)cc1N 161345274 CISLDECQIDXNGH-CYBMUJFWSA-N 296.370 3.336 70 20 CGID COCC(C)(C)C(=O)Nc1ccc(C(F)(F)F)cc1 160575411 LTFNVQPBCDRJGL-UHFFFAOYSA-N 275.270 3.317 70 20 CGID CCc1nc(CN[C@@H](CC2CCC2)c2ccccc2)n[nH]1 160672279 MKTUWHJMBQVPSW-HNNXBMFYSA-N 284.407 3.388 70 20 CGID CC[C@@H](NC[C@H]1CCOC1)c1ccc(F)cc1F 160820235 ALSMMTLMQIURQA-QMTHXVAHSA-N 255.308 3.042 70 20 CGID CS[C@H](C)CC(=O)N[C@@H](C)Cc1ccccc1F 160849052 PPAFXEWMZAUKBA-WDEREUQCSA-N 269.385 3.015 70 20 CGID CC[C@@H](N[C@@H](C)C(=O)OC(C)(C)C)c1nc(C)cs1 160889622 GVHCQDKHZXFSNX-WDEREUQCSA-N 284.425 3.222 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CSc1nncs1 160901952 FJMRXNPYTCDFFV-WDEREUQCSA-N 299.465 3.057 70 20 CGID CCOCCC1(CNC(=O)C[C@H]2CC[C@H](C)C2)CC1 159477239 PTKDCQGAJGMWTA-KBPBESRZSA-N 267.413 3.136 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)s1 159529443 PBOIGKWAGNUVPA-GFCCVEGCSA-N 279.405 3.278 70 20 CGID O=C(CCN1CC[C@@H]2CCCC[C@@H]21)Nc1ccc(F)cc1 159732711 BCCLOBBAKFODAG-BBRMVZONSA-N 290.382 3.419 70 20 CGID C[C@@H](CNc1ccccc1)NC(=O)C[C@@H](C)c1ccncc1 159584275 FTIVZWIDSZFJAJ-CABCVRRESA-N 297.402 3.192 70 20 CGID Cc1cccc(C(=O)Nc2ccc(CCO)cc2)c1Cl 160378603 NJZJMKQLJVSQHL-UHFFFAOYSA-N 289.762 3.436 70 20 CGID Nc1cccc(Cc2nc([C@H]3CCCCS3)no2)c1 160651417 CYKCAHISONWWSE-GFCCVEGCSA-N 275.377 3.201 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCCC[C@H]2OC)cc1OC 217885251 PYNPPTSIFMSYOF-AEGPPILISA-N 293.407 3.312 70 20 CGID Cc1ccc(CCNC(=O)NCCc2ccccc2C)cc1 217307939 UFHHURIDAFTJBR-UHFFFAOYSA-N 296.414 3.388 70 20 CGID C/C(=C\C(C)(C)C)C(=O)Nc1cccc(S(=O)(=O)F)c1 809282287 BMZMZOZBNZQFKN-MDZDMXLPSA-N 299.367 3.276 70 20 CGID CCc1ncc(NC(=O)N(C)[C@H]2CCCC[C@@H]2CC)cn1 161137606 LEHXOTDEWACCNI-JSGCOSHPSA-N 290.411 3.472 70 20 CGID O=C(C1CCC1)N1CC[C@@H](Oc2ccccc2Cl)C1 161351488 HTEKQHTWZPZTCI-GFCCVEGCSA-N 279.767 3.120 70 20 CGID Cc1ccc(C(=O)CCN[C@H](C)c2cccnc2)cc1 161415369 ARMYPTJEPOGATI-CQSZACIVSA-N 268.360 3.314 70 20 CGID Cc1cccc(C(=O)NC2CCN(C(C)(C)C)CC2)c1F 161482496 FECZXVYJIZLKTI-UHFFFAOYSA-N 292.398 3.127 70 20 CGID COc1ccc([C@@H](C)CC(=O)NCC2(C3CC3)CC2)cc1 160011929 WJUWIVLUMJAORD-ZDUSSCGKSA-N 287.403 3.495 70 20 CGID Cc1nccc(NC(=O)NCC[C@@H]2CCCCO2)c1Cl 160043461 FUCGYFJQAKKBKI-NSHDSACASA-N 297.786 3.124 70 20 CGID CC[C@H](Nc1nc(C(C)(C)C)ns1)[C@H]1CCCO1 160117911 XPHBYPDVLRYOGG-VHSXEESVSA-N 269.414 3.205 70 20 CGID COC(=O)c1cc(CNc2ccc(F)c(OC)c2)oc1C 160141191 CJPPUDXZJJPONZ-UHFFFAOYSA-N 293.294 3.134 70 20 CGID CC[C@H](CC(=O)NCCN(C)C(C)C)c1ccc(C)cc1 160180372 GKBCTTKREHNKTJ-MRXNPFEDSA-N 290.451 3.335 70 20 CGID CC[C@H](NC[C@H]1CCc2ccccc21)c1cnn(C)c1 160960697 KMHLZFFNXUXKSW-PBHICJAKSA-N 269.392 3.191 70 20 CGID CCOc1ccccc1NC(=O)N[C@H](CC)[C@@H]1CCCO1 159455659 CIBKWADHGFLFTK-OCCSQVGLSA-N 292.379 3.164 70 20 CGID CN(C(=O)NCCc1cscn1)C1CCC(C)(C)CC1 159577300 NVZMDVLXJOGYMA-UHFFFAOYSA-N 295.452 3.296 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc2ccccc2[nH]1 159582117 RFASIZRSPDYMFH-AAEUAGOBSA-N 256.349 3.476 70 20 CGID CC(C)Oc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)cc1 218117034 QVMRBZNTWHHGBZ-MSOLQXFVSA-N 288.435 3.190 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc(F)c(F)c1 217658457 XWSBBBUZGYGNSM-UVBJJODRSA-N 280.362 3.242 70 20 CGID CO[C@@H]1CCCC[C@H]1N[C@@H](C)c1ccc2c(c1)OCO2 218097146 MKNSOIZANVVJNF-IACUBPJLSA-N 277.364 3.024 70 20 CGID Cc1ccsc1CCCC(=O)N1C[C@H](C)OC[C@@H]1C 161132815 HEAQUOXXSYDOAY-STQMWFEESA-N 281.421 3.015 70 20 CGID Cc1cc(C(=O)N(C)[C@@H](C)c2cc3ccccc3o2)ncn1 161450646 OQWZBFQEMDUJDN-LBPRGKRZSA-N 295.342 3.364 70 20 CGID C[C@H]1CN(C(=O)NC(C)(C)C)C[C@H](c2ccsc2)O1 160185865 IJBPNEBROGIURX-CMPLNLGQSA-N 282.409 3.018 70 20 CGID O=C(Oc1ccc(Oc2nccs2)cc1)[C@@H]1CCCO1 160190296 RNKVSGZTMBOLJY-LBPRGKRZSA-N 291.328 3.020 70 20 CGID COCCN(Cc1ccccc1)Cc1cccc2cn[nH]c12 160444000 MNOJVNWYWUFHRY-UHFFFAOYSA-N 295.386 3.212 70 20 CGID CCOc1ccc(NC(=O)/C=C/c2cnn(C)c2C)c(C)c1 160518853 SLWBRMVMSVGTGV-RMKNXTFCSA-N 299.374 3.088 70 20 CGID CCCO[C@@H]1CCCN(C(=O)NCC(CC)CC)CC1 160587850 LNLDOMDBXDLYFN-OAHLLOKOSA-N 284.444 3.413 70 20 CGID COC[C@H](C)NCc1ccnc(O[C@H](C)CC(C)C)c1 160836362 XNXDBTRXWYSOFJ-UONOGXRCSA-N 280.412 3.020 70 20 CGID CC(C)Sc1ccccc1NC(=O)C1CCN(C)CC1 160904411 WOUWFCMXPQXHFF-UHFFFAOYSA-N 292.448 3.467 70 20 CGID CCc1ccccc1C(=O)N1CCO[C@@H](c2ccccc2)C1 160915424 VVTFNNFCGVWWEC-GOSISDBHSA-N 295.382 3.463 70 20 CGID CCO[C@@H]1CCCN(C(=O)c2ccc(F)c(SC)c2)C1 160945435 QMFPWKNRTDHAPI-GFCCVEGCSA-N 297.395 3.189 70 20 CGID CN(Cc1ccc(Cl)c2cccnc12)[C@H](CN)C1CC1 159765372 QMQRBXKWSLPQLV-OAHLLOKOSA-N 289.810 3.057 70 20 CGID CC[C@H](c1cccc(Br)c1)S(=O)(=O)Cl 88251546 PASIOQPQXNNFOL-SECBINFHSA-N 297.601 3.469 70 20 CGID Cc1c([C@H](C)NCc2cccc3cc[nH]c23)cnn1C 218105210 LCOJIKICDCLQSI-NSHDSACASA-N 268.364 3.061 70 20 CGID COC(=O)Nc1cccc(NC(=O)N[C@@H](C)CC(C)C)c1 161028771 LEFYYHFSAVNCMF-NSHDSACASA-N 293.367 3.421 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cccc2c1OCO2 161184948 GXHATAIXYWVWGU-JSGCOSHPSA-N 289.375 3.456 70 20 CGID CCN(CC)CCC[C@H](C)NC(=O)[C@H]1CCC[C@H](C)C1 161291671 NUIXYWMRUPWTHI-JYJNAYRXSA-N 282.472 3.439 70 20 CGID C[C@H](NC(=O)N[C@H]1C=CCCC1)c1ccc(F)cc1F 161357612 RCEPHGXZIKVKFN-JQWIXIFHSA-N 280.318 3.434 70 20 CGID CCCc1ccc([C@H](C)N[C@@H](CCO)CSC)cc1 160252035 KZJXDDJRNJNGKW-BBRMVZONSA-N 281.465 3.404 70 20 CGID CCc1nc(CN[C@@H](C)c2cccc(OC(C)C)c2)n[nH]1 160317102 MKRQRMNIMWCZSW-LBPRGKRZSA-N 288.395 3.005 70 20 CGID Cc1cc(Cl)ccc1C(=O)N(C)C[C@H]1CCCCO1 160379981 YZWBDHWBBLUUQW-CYBMUJFWSA-N 281.783 3.290 70 20 CGID O=C(NCC1(c2ccccc2)CCCC1)[C@@H]1CCCCO1 160387401 HRYUWSLNQHEAIC-INIZCTEOSA-N 287.403 3.184 70 20 CGID CCn1cc([C@H](C)NC[C@@H](C2CCCCC2)N(C)C)cn1 160389691 CZBUOVKLKNHOGS-YOEHRIQHSA-N 292.471 3.064 70 20 CGID Cc1ccc(NC(=O)c2cccc(C)c2F)c(O)c1 160401453 QFJFGLMYQGTOMI-UHFFFAOYSA-N 259.280 3.400 70 20 CGID Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(N)=O)s2)cc1 160799959 IKTDULBIYCBLTA-LLVKDONJSA-N 289.404 3.498 70 20 CGID Cc1c(/C=C/C(=O)N(C2CC2)[C@@H](C)c2ccco2)cnn1C 160886578 IXLGLDJPRRKOQY-PPGNKHEKSA-N 299.374 3.087 70 20 CGID CC[C@]1(C)CCCN(C(=O)NCC2(CCOC)CC2)C1 160976689 RFVPXMDCIVOZGN-OAHLLOKOSA-N 282.428 3.025 70 20 CGID C[C@H](C(=O)NCc1nc2ccccc2[nH]1)c1cccs1 159820765 IZZQTHXOYBOJED-JTQLQIEISA-N 285.372 3.044 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2NC(=O)NC1CCCCC1 159439029 JILYHJQMYLWWHS-INIZCTEOSA-N 287.407 3.278 70 20 CGID CCOCCCN1CCC[C@@H]1c1cccc(F)c1 159444675 QGWXMPVVJOTSEI-OAHLLOKOSA-N 251.345 3.389 70 20 CGID CCCC(=O)Nc1cccc(CN[C@H](COC)C(C)C)c1 159922522 LVMZSHGXGWFGDT-MRXNPFEDSA-N 292.423 3.186 70 20 CGID Cc1ccc2c(c1)N(C(=O)c1ccc(CN)cc1)CCC2 159748598 QQQBIXDJFIIDKQ-UHFFFAOYSA-N 280.371 3.047 70 20 CGID Cc1cc(F)ccc1C(=O)NCc1nc(C2CC2)cs1 159386909 GXEUCNLSPRUFIZ-UHFFFAOYSA-N 290.363 3.398 70 20 CGID Cc1ccc(NC(=O)COc2ccc(F)cc2C)cc1 160712033 CLAXOYIWTJQEMH-UHFFFAOYSA-N 273.307 3.460 70 20 CGID COc1ccccc1NC(=O)N1[C@H]2C=CC[C@H]1CC2 218754909 HNRIKMYEKRQULW-RYUDHWBXSA-N 258.321 3.020 70 20 CGID c1sc(C2CC2)nc1CN(C[C@@H]1CCOC1)C1CC1 161410425 NJWDCADJQLLJJI-NSHDSACASA-N 278.421 3.021 70 20 CGID O=C(CC1=CCCCC1)Nc1cccc(S(=O)(=O)F)c1 769660892 TYPYZYQMXKBJRN-UHFFFAOYSA-N 297.351 3.174 70 20 CGID CN(C)[C@H]1CCC[C@@H](N[C@@H]2CCc3cc(F)ccc32)C1 161003235 VXGODTAGULUNAT-HLLBOEOZSA-N 276.399 3.275 70 20 CGID CC(C)Oc1ccc([C@H](C)NC(=O)[C@@H]2CCCCO2)cc1 161080926 GOYNNZBNXUQFAH-BBRMVZONSA-N 291.391 3.220 70 20 CGID CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)[C@H](C)CNC 161247534 FHXLJQVYNDMKQC-WBVHZDCISA-N 290.451 3.020 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CCn1cc(C)cn1 161267557 RQDMZTAFFNHIDY-HUUCEWRRSA-N 277.412 3.009 70 20 CGID CC[C@@H](N[C@H](C)CCOC)c1ccc(F)cc1F 160859687 XUXOTXSIMCCAKD-QMTHXVAHSA-N 257.324 3.431 70 20 CGID C[C@@H]1OCCN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)[C@H]1C 159675106 WYGIVHRWVIBELQ-RFBLXINOSA-N 279.424 3.229 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccc(Cl)cc1 159943349 KEAIPKPPLSLCMB-MFKMUULPSA-N 267.756 3.086 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(C)n(CC)c1C 159577545 TUVZHTMGMCISSN-UKRRQHHQSA-N 262.397 3.433 70 20 CGID CN(C)[C@H](CNCc1cc(F)cc(Cl)c1)c1ccco1 160812463 XVQHQPKFVPSBTB-CQSZACIVSA-N 296.773 3.465 70 20 CGID Fc1cccc(C2CC(N[C@@H]3CCN4CCCC[C@@H]34)C2)c1 217691792 DAIWEKBTOAOYMR-SYNTWQANSA-N 288.410 3.288 70 20 CGID COC(=O)N1CCC[C@H]1c1cccc(Br)c1 217246250 SHSJJZFOPTZLEC-NSHDSACASA-N 284.153 3.352 70 20 CGID CC[C@@H](NC(=O)CCC1CCC1)c1c(C)noc1C 160267319 JSPNGNRKQDMVDN-CYBMUJFWSA-N 264.369 3.439 70 20 CGID CC1(C)Cc2cccc([C@H]3NC(=O)c4ccccc4N3)c2O1 161436117 LIUBYYHVMQWXSL-MRXNPFEDSA-N 294.354 3.254 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(C(F)(F)F)nc1 160133784 SEXIKQFJERDUOS-UHFFFAOYSA-N 284.281 3.020 70 20 CGID CCCc1ccc([C@H](NCc2nncn2C)C(C)C)cc1 160714379 ZITXLDLVBFFSQI-QGZVFWFLSA-N 286.423 3.255 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cccc(NC(=O)C2CC2)c1 160965253 DPLKOUPGLVVSDS-WMLDXEAASA-N 286.375 3.410 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cccc(-c2nnco2)c1 160990496 RRXJTDQJTOBLMV-IUODEOHRSA-N 271.320 3.111 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)NCC1(C2CC2)CC1 159855924 XGJYUTKOHYAAIW-QWHCGFSZSA-N 275.417 3.466 70 20 CGID CCCCc1nnc(NC(=O)N[C@@H](C)C2CCC2)s1 159506621 YJHNDFFEXACKJR-VIFPVBQESA-N 282.413 3.191 70 20 CGID CCOC(C)(C)CNc1ccc(C(F)(F)F)cn1 159525645 XTILLZBLOIBZNZ-UHFFFAOYSA-N 262.275 3.327 70 20 CGID CCC1(CNC(=O)Nc2ccn(CCC(C)C)n2)CC1 159950551 JPXWFTJFCBCMMU-UHFFFAOYSA-N 278.400 3.241 70 20 CGID CN(C(=O)[C@@H](c1ccccc1)C1CC1)c1ccccn1 159966798 WLHXYRJYDYORNH-INIZCTEOSA-N 266.344 3.238 70 20 CGID CCc1nnc(COc2ccc(C)cc2Cl)o1 160898229 WLRZAMOGURZZJX-UHFFFAOYSA-N 252.701 3.173 70 20 CGID Cc1ccc(S(=O)(=O)N2[C@H]3C=CC[C@H]2CC3)cc1Cl 218758679 SKDHRTMBZGMIFE-RYUDHWBXSA-N 297.807 3.130 70 20 CGID Cc1ccc(C(=O)N[C@@H](C)C[C@@H](O)c2ccccc2)cc1 218679320 LEEPNCXGASNCIA-WMLDXEAASA-N 283.371 3.237 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2nc(C)c(C)o2)n1 160148749 CKGVIDSMJYHAIT-HNNXBMFYSA-N 271.364 3.332 70 20 CGID C[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 864238862 QTSXSDRHAHNZPG-IINYFYTJSA-N 299.367 3.110 70 20 CGID CCCC1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CCC1 776368220 REIPHLIRRLTVRH-UHFFFAOYSA-N 299.367 3.254 70 20 CGID CC(C)n1nccc1C(=O)N[C@H]1C[C@H]1C1CCCCC1 160099092 YVOPKFANUKIUPE-KBPBESRZSA-N 275.396 3.163 70 20 CGID CC1(C)C[C@@H](NC2CCN(C3CCCC3)CC2)C(C)(C)O1 160501624 UXXJIMATUKJVHR-MRXNPFEDSA-N 294.483 3.329 70 20 CGID CCOCCC1(C(=O)NCCCc2ccccc2)CCC1 160622560 ZDTORGWQQRDTFD-UHFFFAOYSA-N 289.419 3.332 70 20 CGID CCOCCCN[C@@H](CC)c1ccc(F)cc1F 160656280 OVXQJZFUYFIKJW-AWEZNQCLSA-N 257.324 3.432 70 20 CGID CC[C@@H](OC1CCCCC1)C(=O)Nc1ccccc1O 160953830 XEPBLRUETZIUDK-OAHLLOKOSA-N 277.364 3.459 70 20 CGID CC1(C)C[C@@H](NC(=O)NCc2cccc(Cl)c2)CCO1 160989963 MVCBZKSWIRHSKZ-ZDUSSCGKSA-N 296.798 3.097 70 20 CGID Cc1cc(N[C@@H](C)c2ccc(F)cc2F)nn1C 159651461 FXWPYWFNLYPWGG-VIFPVBQESA-N 251.280 3.180 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)c2ccncc2)C1 159665376 ZTZGNCGYTCEALS-LBPRGKRZSA-N 284.384 3.470 70 20 CGID CC(C)[C@@H](O)CNC(=O)c1ccc(Oc2ccccc2)cc1 159695568 ZOOSFKBTRCZMAL-KRWDZBQOSA-N 299.370 3.226 70 20 CGID C[C@H](NC(=O)Nc1ccn(-c2ccccc2)n1)C1CCC1 159766514 RIILWEUDJRLBCF-LBPRGKRZSA-N 284.363 3.182 70 20 CGID Cc1ccsc1CN[C@H]1[C@H]2CCO[C@@H]2C12CCC2 159581054 XTAPOQGAOIEESW-XBFCOCLRSA-N 263.406 3.104 70 20 CGID CC[C@@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(Cl)cc1 159986419 LVAFHEKHTLUPFL-UTUOFQBUSA-N 282.815 3.294 70 20 CGID CC[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccc(OC)cc1 217659692 CULWOIYAUWPDEH-KSZLIROESA-N 288.435 3.363 70 20 CGID CC1CCC(N(C(=O)[C@H]2CCCCO2)C2CC2)CC1 161027439 NIZRXGWPDCFOJG-SSDMNJCBSA-N 265.397 3.125 70 20 CGID Cc1cc(C)c2ncc(C(=O)N3CCC[C@@H](C)C3)c(O)c2c1 161180500 KJRROUCOZXNZKC-LLVKDONJSA-N 298.386 3.429 70 20 CGID Cc1nc(CC(=O)N2CCC[C@H]3CCC[C@@H]32)c(C)s1 161324447 BTNXNPWGGBYZDW-OCCSQVGLSA-N 278.421 3.094 70 20 CGID CC(C)OCCSCCC(=O)N(C)c1ccccc1 160122494 TUSBONWUKZZPMP-UHFFFAOYSA-N 281.421 3.198 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@H]1CCCS1 160152966 RHXPZMVNWRENJJ-CMPLNLGQSA-N 267.419 3.137 70 20 CGID CC[C@H]1CCCN(C(=O)c2c(F)cc(F)cc2F)C1 160317131 SUOFDJCZZHGNBE-VIFPVBQESA-N 271.282 3.366 70 20 CGID CSC[C@H](CCO)N[C@@H](Cc1ccc(C)cc1)C(C)C 160394610 LJVICMQUHOVGNP-IRXDYDNUSA-N 295.492 3.266 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(-c2csnn2)cc1 160712138 KTKYMBCRTRKEHQ-VIFPVBQESA-N 293.417 3.285 70 20 CGID CS[C@@H](C)CC(=O)Nc1nc(C2CC2)cs1 160836357 JSPKNTGJSLIMBC-ZETCQYMHSA-N 256.396 3.101 70 20 CGID CCN(C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)C1CC1 160927247 FCFYNIZZFJEIHS-GOEBONIOSA-N 288.391 3.101 70 20 CGID COCC(C)(C)C(=O)N[C@@H]1CCSc2ccc(F)cc21 160891632 IXISWDACSWDZHQ-GFCCVEGCSA-N 297.395 3.151 70 20 CGID CCCN(C)C(=O)Nc1ccc(CCC(=O)OCC)cc1 159569520 NBEOUBBMLJUVFM-UHFFFAOYSA-N 292.379 3.056 70 20 CGID C[C@H](O)C[C@H](CNC(=O)c1cccs1)c1ccccc1 159778029 LAJIDUAWXOSYCH-GXTWGEPZSA-N 289.400 3.033 70 20 CGID CCSCC[C@@H](C)NCc1cc(OC)c(O)c(OC)c1 160067737 RLOJBCKPHOYDKG-LLVKDONJSA-N 299.436 3.031 70 20 CGID C[C@H](CNCc1cccc2cc[nH]c12)CN1CCCCC1 218119608 DOYKTYKAMLQDIE-OAHLLOKOSA-N 285.435 3.380 70 20 CGID CC(C)=CCOC(=O)c1cnn(-c2ccccc2F)c1C 218488711 AMJHVALWGWAHHE-UHFFFAOYSA-N 288.322 3.443 70 20 CGID c1ccc([C@H]2CCN(CCCN3CCCCC3)C2)cc1 161300013 SMXZMWIAQGVZNB-SFHVURJKSA-N 272.436 3.352 70 20 CGID CCOCCC1(C(=O)Nc2cccc3cn[nH]c23)CCC1 161100407 YXXUGJWHUBRHND-UHFFFAOYSA-N 287.363 3.098 70 20 CGID C[C@H](NC(=O)C1CCC(C)(C)CC1)C(C)(C)CN(C)C 161114319 APDDQHVGRQIYSH-ZDUSSCGKSA-N 282.472 3.295 70 20 CGID Cc1ccc(CCNC(=O)NC2(C)CCC2)c(C)c1 160063552 HDNJIQMHNXDDPY-UHFFFAOYSA-N 260.381 3.088 70 20 CGID CCCCOCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160319738 MGIJMLUATLYTPK-LBPRGKRZSA-N 291.269 3.045 70 20 CGID Cc1cnc(C(C)(C)NC(=O)c2cc(C(C)C)on2)s1 160472545 DQWDLIBVNFZMRN-UHFFFAOYSA-N 293.392 3.228 70 20 CGID CN(CCC1CCOCC1)c1nccc2occc12 160539824 BXBNRSFBGSBOSL-UHFFFAOYSA-N 260.337 3.081 70 20 CGID Cc1cccc(-c2[nH]ncc2CN[C@@H]2CCOC(C)(C)C2)c1 160632719 RPGIQZCPLOIIDQ-MRXNPFEDSA-N 299.418 3.432 70 20 CGID CCc1ccc(CNC(=O)NC[C@]2(C)CCCS2)s1 160686342 QCIGMXAIBDFMCL-AWEZNQCLSA-N 298.477 3.395 70 20 CGID CCCCN(C)C(=O)c1ccnn1C(CC)CC 160758508 WGTDVSFAFYPPNO-UHFFFAOYSA-N 251.374 3.116 70 20 CGID CC(C)CONC(=O)Nc1ccc2nc(C3CC3)oc2c1 160829980 ZZMZKIVWFKQUHP-UHFFFAOYSA-N 289.335 3.414 70 20 CGID CC[C@H](NC[C@@H]1CCc2ccccc21)[C@@H]1CCOC1 160993936 URQMWVYICJHHHU-UXLLHSPISA-N 259.393 3.121 70 20 CGID CCCC[C@H](CCC)NC(=O)N(C)CC1CCOCC1 159654365 BORXZFFFFZGDTQ-HNNXBMFYSA-N 284.444 3.413 70 20 CGID CCC(C)(CC)C(=O)NCCC[C@@H]1CCCCO1 159487756 DYPAYIVWZYMPJG-ZDUSSCGKSA-N 255.402 3.278 70 20 CGID COc1ccc2c(c1)C[C@H](N[C@H]1CCOC(C)(C)C1)CC2 159976052 PVZBAYRNGIKKMV-CVEARBPZSA-N 289.419 3.100 70 20 CGID C[C@H](CCc1ccco1)NC[C@@](C)(O)c1ccsc1 159976902 RNXVBQCPRHBCIN-IUODEOHRSA-N 279.405 3.160 70 20 CGID C1CCN(CCCN2CCS[C@@H]3CCCC[C@@H]32)CC1 161493998 MODAYSVFLKEXHH-JKSUJKDBSA-N 282.497 3.222 70 20 CGID Cc1nnc(CSCc2cccc(Cl)c2)n1C 161036493 PJHSBFMNKBZXFC-UHFFFAOYSA-N 267.785 3.210 70 20 CGID CCN(Cc1ccc(OC(F)F)cc1)Cc1cnn(C)c1 161134803 DHNPGWZOGJWESZ-UHFFFAOYSA-N 295.333 3.044 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)NCC1(C2CC2)CCC1 161295075 XZEXXHDFQJHOQD-LLVKDONJSA-N 290.407 3.482 70 20 CGID COCC[C@@H](C)NCCc1csc(-c2ccccc2)n1 160388375 WIJRPKPEKXNWDE-CYBMUJFWSA-N 290.432 3.367 70 20 CGID CCOc1cccc(NC(=O)C[C@@H](C)SC)c1 160491711 NPBQPMJXBNMTHL-SNVBAGLBSA-N 253.367 3.165 70 20 CGID CC(C)c1cc(=O)n(Cc2cccc(OC(F)F)c2)cn1 160659024 GFJGDJMIHPGMFD-UHFFFAOYSA-N 294.301 3.016 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)c1cccc(F)c1 160701415 SNDPZKBJRNNLJC-SNVBAGLBSA-N 291.347 3.279 70 20 CGID CS(=O)(=O)CCCCSCc1ccc(Cl)cc1 160900338 BWXYEFWKZRJIKG-UHFFFAOYSA-N 292.853 3.398 70 20 CGID C[C@@H](Cc1ccc(Cl)cc1)N(C)CCn1ccnc1 159836289 QZRULECNEIFAHU-ZDUSSCGKSA-N 277.799 3.100 70 20 CGID CC(C)n1cc([C@@H](C)N[C@@H]2CCCSC2)cn1 159640212 DUUCOPYVURJWQW-DGCLKSJQSA-N 253.415 3.010 70 20 CGID CCc1cccc(NC(=O)N[C@@H](CC)[C@H]2CCCO2)c1 159459775 ZSIQCQATOCMRPL-LSDHHAIUSA-N 276.380 3.328 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCc2ccc(OC)cc21 160081579 JQTRLPFRENKPSM-SUMWQHHRSA-N 276.424 3.002 70 20 CGID CCN(CCCO)C(=O)c1sccc1-c1ccccc1 160560874 VKPLVPXNZFIIFB-UHFFFAOYSA-N 289.400 3.260 70 20 CGID CCCC(=O)NC[C@H]1CCCN(CCC2CCCC2)C1 160220107 VYHUDTZGMQJHGM-MRXNPFEDSA-N 280.456 3.195 70 20 CGID CCOc1ccccc1[C@H](C)N[C@@H]1CCN2CCCC[C@@H]12 217659340 VFEWUDXRCXHVIO-UAGQMJEPSA-N 288.435 3.363 70 20 CGID CCCCNC(=O)COc1ccc([C@H](C)CC)cc1 217342586 DISZKQXIBYYCOD-CYBMUJFWSA-N 263.381 3.495 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H](C)c1cccnc1Cl 161173316 UXOXPQQGPWYJJZ-QWHCGFSZSA-N 281.831 3.260 70 20 CGID CC[C@@H](NCC1(c2ccc(F)cc2)CC1)[C@@H]1CCOC1 161371386 CXMXSOYOHUOPMV-CZUORRHYSA-N 277.383 3.262 70 20 CGID COc1cc(N[C@H](C)c2cncs2)ccc1F 160146097 GQLUQSDNAIJTBQ-MRVPVSSYSA-N 252.314 3.464 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccc2c(c1)CCCC2 160160712 GXYJTTVPLRQIRH-DYVFJYSZSA-N 287.403 3.312 70 20 CGID Cc1cccc2nc(CN[C@@H]3CCc4ccccc43)cn12 160301109 WWMZZAIRFQUJFR-QGZVFWFLSA-N 277.371 3.420 70 20 CGID CCCOc1cccc(NC(=O)N(C)[C@H]2CCSC2)c1 160508738 LMPBCQWEYNMXMX-ZDUSSCGKSA-N 294.420 3.445 70 20 CGID CCOc1cc(CN[C@@H]2CCOC(C)(C)C2)ccc1OC 160552632 QFMILKFTYVLCJB-CQSZACIVSA-N 293.407 3.141 70 20 CGID COc1ccc(NC(=O)N[C@H](C)CC(C)C)cc1F 160560201 UQCDOCVISGFBGO-SNVBAGLBSA-N 268.332 3.390 70 20 CGID CC(C)NC(=O)COc1ccc(Cc2ccccc2)cc1 159429781 BJCAJMIUYXEVNB-UHFFFAOYSA-N 283.371 3.181 70 20 CGID Cc1c(Cl)cccc1NC(=O)N[C@H]1CC[C@H](O)CC1 159829209 YCDFOVSEVXPTQY-PHIMTYICSA-N 282.771 3.073 70 20 CGID CCCc1ccccc1NC(=O)NCCc1cscn1 159463976 CGTGXBVFDUUPHX-UHFFFAOYSA-N 289.404 3.460 70 20 CGID Cn1ccnc1SCC(=O)CCC1CCCC1 159916730 HIYQCBJUAFASNM-UHFFFAOYSA-N 252.383 3.052 70 20 CGID CC(C)(C)Cc1cc(NC(=O)CCCn2cccc2)[nH]n1 159683895 HQLHRRCLYNBPQS-UHFFFAOYSA-N 288.395 3.219 70 20 CGID C[C@H](NC(=O)c1ccn(C2CCCC2)n1)c1cccc(O)c1 159703121 IZSSIWIIHGYQRB-LBPRGKRZSA-N 299.374 3.195 70 20 CGID Cc1nc2cc(NC(=O)CCCn3cccc3)ccc2n1C 159745709 PIZPAZRVMWNLEO-UHFFFAOYSA-N 296.374 3.102 70 20 CGID CCc1ncnc(N[C@@H]2CCC[C@@H](SC)C2)c1F 218024044 OFOMQWCBJQQRGH-NXEZZACHSA-N 269.389 3.264 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1ccnc2ccccc12 161418155 SRZUWLAAOMEDMH-RYUDHWBXSA-N 254.333 3.248 70 20 CGID COC[C@H](NC(=O)Nc1ccc2[nH]c(C)cc2c1)C1CC1 160069452 QYVMZHLSVNFZSJ-HNNXBMFYSA-N 287.363 3.023 70 20 CGID CSC[C@H](CCO)N[C@@H]1C[C@H](C)CC[C@@H]1C(C)C 160433721 VZRHHJQWONWNGK-LXTVHRRPSA-N 273.486 3.151 70 20 CGID CC1(C)C[C@H]1C(=O)Nc1nc(CN2CCCCC2)cs1 160514876 NCWFADIZSVJEFL-LBPRGKRZSA-N 293.436 3.114 70 20 CGID CC[C@@H](NC(=O)C1(C)CCC1)c1c(C)noc1C 160570469 YFCYQZVKGAQKSD-LLVKDONJSA-N 250.342 3.049 70 20 CGID Cc1ccc(-c2n[nH]cc2CN[C@H]2CCOC(C)(C)C2)o1 160647039 VPCJSXQAFJSQDD-ZDUSSCGKSA-N 289.379 3.025 70 20 CGID Cc1ccc(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)cc1C 160672069 RSTQVCMDQNWCSX-HNNXBMFYSA-N 292.423 3.468 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)cn1 160681878 CAVDVUIHAWTJJH-HNNXBMFYSA-N 288.391 3.002 70 20 CGID CCc1c(Cl)nc(C)nc1N[C@H]1CCOC(C)(C)C1 160686952 NQFGEEDPHAVABK-JTQLQIEISA-N 283.803 3.370 70 20 CGID CC(C)(C)[C@H]1CCN(CC(=O)c2ccccc2F)C1 160726263 FWBOXHPJYPPDDI-LBPRGKRZSA-N 263.356 3.376 70 20 CGID CC(C)[C@@H](Cc1ccccc1)C(=O)N(C)Cc1cccn1C 160823240 VQFKSUHREOECJM-GOSISDBHSA-N 298.430 3.498 70 20 CGID Fc1ccc(F)c(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159606380 HOAVZTVNKSFAQD-QEJZJMRPSA-N 279.330 3.012 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@H]1CCC[C@@H](C)C1 159925943 HQBLAKICAUEHJX-HIFRSBDPSA-N 289.423 3.058 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(NC(C)=O)ccc1OC 159369917 ANCVNWTULMOVLA-MLGOLLRUSA-N 290.363 3.028 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(-c2cccnc2)on1 159592105 XMTDKIXEHHPZHW-DGCLKSJQSA-N 285.347 3.045 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)n1 159977062 HWWYKFOTAPBLGW-MXWKQRLJSA-N 281.425 3.205 70 20 CGID CC(C)(C)[C@@H]1CCN(C(=O)Nc2cccc(CN)c2)C1 160979118 QAPZZORXEIIAOO-CYBMUJFWSA-N 275.396 3.045 70 20 CGID CCC(CC)NC(=O)c1sccc1-n1cccc1 218489901 IYMIDIIJZDGKLI-UHFFFAOYSA-N 262.378 3.457 70 20 CGID C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239103 XRUOWEKRZZEVGE-GWCFXTLKSA-N 299.367 3.110 70 20 CGID CCOCCC1(C(=O)NC2CCCCC2)CCC1 161135544 KXRMITYIGSANDS-UHFFFAOYSA-N 253.386 3.032 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCCSc1ccccc1 160121953 IDXNNSYOLQWVLS-DZGCQCFKSA-N 263.406 3.331 70 20 CGID COc1ccc(NC(=O)COc2ccc(F)cc2C)cc1 160719353 VTEJZYBRCGNXHY-UHFFFAOYSA-N 289.306 3.160 70 20 CGID CCCn1c(C)nnc1CN(C)C1CCC(C)(C)CC1 160943173 RMWMRUGBTNAJIA-UHFFFAOYSA-N 278.444 3.397 70 20 CGID Cc1ccc(NC(=O)N[C@H](C)C2CCC2)cc1F 159419005 UOJCMJHNUKKCHW-SNVBAGLBSA-N 250.317 3.444 70 20 CGID Cc1ccc2nc(NC(=O)[C@H]3CCCCO3)sc2c1 159546161 IMWSZCWYQJAASV-LLVKDONJSA-N 276.361 3.112 70 20 CGID CCc1nsc(N[C@@H]2CCCc3cc(N)ccc32)n1 159514266 GIJANNWALVVUOR-GFCCVEGCSA-N 274.393 3.172 70 20 CGID CC(=O)c1ccc(C(=O)Nc2ccc3nc[nH]c3c2)cc1 217726629 RGAKXKYSZYOMJZ-UHFFFAOYSA-N 279.299 3.018 70 20 CGID Clc1cc(N[C@@H]2CCN3CCCC[C@@H]23)nc(C2CC2)n1 217455682 FPQMQVIUYGKRGX-NEPJUHHUSA-N 292.814 3.046 70 20 CGID COc1ccc(C(=O)NC[C@@H]2CCC[C@@H](C)C2)c(F)c1 218012934 IVVYEKHNZMJJPU-VXGBXAGGSA-N 279.355 3.390 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)c2ccc3[nH]cnc3c2)C1 161214297 DBWUPVDTDSUGHG-CYBMUJFWSA-N 285.391 3.461 70 20 CGID CCC[C@@H](C)NC(=O)[C@@H](C)SCc1c(CC)noc1C 160040685 BFJPXAQTQNELQV-ZYHUDNBSSA-N 298.452 3.472 70 20 CGID COc1cc(NCc2nn(C)c3ccccc23)ccc1F 160302571 PTESWERXVBEVRG-UHFFFAOYSA-N 285.322 3.333 70 20 CGID C[C@@H](CCC(=O)NCC1(O)CCCCC1)c1ccccc1 160571841 AUPWNFIOJDJBNS-HNNXBMFYSA-N 289.419 3.382 70 20 CGID CC(C)CN(CC(C)C)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160640769 LIPZGHZZIHGFJP-CVEARBPZSA-N 296.455 3.268 70 20 CGID CCCC1(CNC(=O)[C@@H](OC)c2ccccc2)CC1 160679222 GUJKTAZAZURJQO-AWEZNQCLSA-N 261.365 3.071 70 20 CGID CCCCn1ncc(C(=O)NCc2cccc(F)c2)c1C 160949133 PKFOQIHDQDQNIH-UHFFFAOYSA-N 289.354 3.061 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cccc(NC(=O)C2CC2)c1 160965034 DPLKOUPGLVVSDS-RHSMWYFYSA-N 286.375 3.410 70 20 CGID CC(C)Oc1ccccc1NC(=O)N(C)[C@H]1CCSC1 160972456 XSFOQMULYNLFRY-LBPRGKRZSA-N 294.420 3.443 70 20 CGID Cc1nnc([C@@H](C)N[C@H](C)c2cccc(F)c2F)o1 159404993 BAKURZYXSLMGJA-HTQZYQBOSA-N 267.279 3.068 70 20 CGID CCO[C@@H](C)C(=O)N1C[C@@H](C)CSc2ccccc21 159520721 MFZMCQRJZJUIDI-NEPJUHHUSA-N 279.405 3.186 70 20 CGID CC(C)C(=O)NCCCN[C@H](C)c1cccc(Cl)c1 159971871 HSRYURWWLOYMND-GFCCVEGCSA-N 282.815 3.153 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccc(F)cc1 217680538 HJDCDKXKPCABKR-MAZHCROVSA-N 262.372 3.103 70 20 CGID c1cc(CNCCCOCC2CC2)c2[nH]ccc2c1 218080324 GGDWMNROTUVXDJ-UHFFFAOYSA-N 258.365 3.074 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)cc1F 161023080 LLJCXDISAOAFLS-DZGCQCFKSA-N 292.354 3.213 70 20 CGID C[C@@H](CCO)CNC(=O)C1CCC(c2ccccc2)CC1 161048496 STPKJPIFTUMGKQ-OOHWJJMZSA-N 289.419 3.095 70 20 CGID CC(C)CCn1ccc(NC(=O)N2[C@H](C)CC[C@H]2C)n1 161196067 SWPGXKUIBXYJRE-CHWSQXEVSA-N 278.400 3.334 70 20 CGID CC(C)Cn1cc(NC(=O)N(CC2CC2)CC2CC2)cn1 161341636 RTWPJUHVCLNHSI-UHFFFAOYSA-N 290.411 3.193 70 20 CGID Fc1ccc(Cn2nc(C3CC3)nc2C2CC2)cc1F 161509638 PBTAGWZVGUXAFL-UHFFFAOYSA-N 275.302 3.359 70 20 CGID Clc1cc(N[C@@H]2CCO[C@H](C3CC3)C2)ccn1 160299796 SEUJDUXDPQZMOB-NEPJUHHUSA-N 252.745 3.105 70 20 CGID CC(C)CN1CCC[C@@H]1CNC(=O)c1ccccc1Cl 160426452 HXQFHOAWQAXNFR-CYBMUJFWSA-N 294.826 3.190 70 20 CGID CC1(C)CCC(C(=O)N2CC[C@@H](CN3CCCC3)C2)CC1 160616141 GEGQBKFCOVWVSY-HNNXBMFYSA-N 292.467 3.147 70 20 CGID CSc1ccccc1NC(=O)N[C@@H]1CCOC(C)(C)C1 160876761 JUWHOEPTPLGXBH-LLVKDONJSA-N 294.420 3.488 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1csc(COC)n1 160983508 LCCWHLWGYSHOAZ-YPMHNXCESA-N 296.436 3.330 70 20 CGID CC(C)n1cc([C@@H](C)N[C@H]2CCCSC2)cn1 159640454 DUUCOPYVURJWQW-YPMHNXCESA-N 253.415 3.010 70 20 CGID O=C(Nc1nc2ccc(Cl)cc2s1)[C@@H]1CCCCO1 159654270 NFHFBBKKWJMLKG-JTQLQIEISA-N 296.779 3.457 70 20 CGID CC(C)CN1CC[C@H](CNc2nc(C(C)(C)C)ns2)C1 159944420 QLYSEZBPYAFVRT-GFCCVEGCSA-N 296.484 3.225 70 20 CGID C[C@@H](NC(=O)C1CCC(C)(C)CC1)C1CCOCC1 159376205 NTGVVANOPMSGQR-GFCCVEGCSA-N 267.413 3.134 70 20 CGID CC(C)CO[C@@H]1C[C@@H](N[C@@H]2CCOC(C)(C)C2)C1(C)C 159959913 MPFGEECIFPUPMK-RBSFLKMASA-N 283.456 3.373 70 20 CGID C[C@H]1CC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)CC1 864237835 ADDCVJBWBMGQSX-XYPYZODXSA-N 299.367 3.110 70 20 CGID COc1ccc([C@H](O)CNC[C@H]2CCCC[C@@H]2C)cc1 218437628 BTCAGVSYAPNFMX-YSVLISHTSA-N 277.408 3.145 70 20 CGID CC[C@@H](NC(=O)[C@H]1CCCCO1)c1cccc(Cl)c1 161066484 YFROOYHKBWAKPS-ZIAGYGMSSA-N 281.783 3.476 70 20 CGID COc1ccc(COCCCNC(C2CC2)C2CC2)cc1 161069807 DOIMCKDZAWIDHL-UHFFFAOYSA-N 289.419 3.380 70 20 CGID C[C@@H](N[C@@H]1CCN(C2CCCCC2)C1=O)c1ccccc1 160156866 OSGKUNZRCXNAGJ-RHSMWYFYSA-N 286.419 3.271 70 20 CGID CC[C@@H](C)[C@@H](N)C(=O)Nc1sc2c(c1C)CCCC2 160988286 RLOZQVKAOIOORS-NOZJJQNGSA-N 280.437 3.247 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)NCC1(c2ccccc2)CCC1 159412355 RIMQZTPMUWPELB-PBHICJAKSA-N 299.414 3.230 70 20 CGID CN(CCc1nccs1)C(=O)Nc1ccc(F)c(F)c1 159912755 FCWIBHDLJZEGST-UHFFFAOYSA-N 297.330 3.128 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)CSCc1ccccn1 159759582 FQFJPKFFPXNULT-TZMCWYRMSA-N 278.421 3.010 70 20 CGID Cc1ncncc1C(=O)N1C[C@@H](C)CSc2ccccc21 159590551 MOUIRGNOWRMGJA-LLVKDONJSA-N 299.399 3.174 70 20 CGID Cc1cccc(OCCCCS(=O)(=O)Cl)c1C 100495497 OCYLZMAWTYRQAA-UHFFFAOYSA-N 276.785 3.031 70 20 CGID O=C(NC1CCCCC1)c1ccc(C(F)(F)F)cn1 161094099 ZOYAHCFPVABGQI-UHFFFAOYSA-N 272.270 3.163 70 20 CGID COC(=O)C1(NCCSc2ccccc2)CCCCC1 217231709 PQZAVPQUORLERM-UHFFFAOYSA-N 293.432 3.244 70 20 CGID O=C(NCc1ccccc1)Nc1cc(Cl)ccn1 217278254 XKBLBSAIUBMYHV-UHFFFAOYSA-N 261.712 3.057 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2c(C)noc2C)n1 159739922 BUBWQWNYFRXBEA-MRXNPFEDSA-N 271.364 3.332 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cccc(Cl)c1F 159937144 GZWXDHCTSIHGBR-UHFFFAOYSA-N 267.731 3.399 70 20 CGID C[C@@H]1C[C@@H]1c1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)o1 217654155 GQUWELFIMUSVGY-BVUBDWEXSA-N 274.408 3.119 70 20 CGID Cc1cc(C)c(CN[C@@H]2CCN3CCCC[C@@H]23)cc1C 218126899 ODXKAJDQIRXZHV-MSOLQXFVSA-N 272.436 3.328 70 20 CGID Cc1c(Cl)cccc1NCc1nnc2n1CCCC2 217317460 XJGNBKGFWWAIGG-UHFFFAOYSA-N 276.771 3.188 70 20 CGID CCN(Cc1cccc(OC(F)F)c1)Cc1cnn(C)c1 161137264 ZGDYTZBMIFLUQB-UHFFFAOYSA-N 295.333 3.044 70 20 CGID CN(C)c1ccc(C(=O)Nc2ccc(Cl)cn2)c(F)c1 160073914 BQKDRTQXRMBWHD-UHFFFAOYSA-N 293.729 3.192 70 20 CGID Cc1cccc([C@@H](C)C(=O)N(C)c2ccc3c(c2)OCO3)c1 160089015 WYETXGHRUQJXEO-CYBMUJFWSA-N 297.354 3.490 70 20 CGID Cc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)cc1C 160140020 MVVZNKUIJKPDDA-UHFFFAOYSA-N 283.327 3.309 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCCO1)c1ccc2c(c1)CCCC2 160160936 GXYJTTVPLRQIRH-CXAGYDPISA-N 287.403 3.312 70 20 CGID CC[C@H](C(=O)NC[C@H](OC)C(C)(C)C)c1ccc(F)cc1 160641935 LHEZDINOHIIHMF-GJZGRUSLSA-N 295.398 3.497 70 20 CGID CC(C)n1nccc1C(=O)Nc1nc(C2CC2)cs1 160898333 ZZFOVRBONDVPBK-UHFFFAOYSA-N 276.365 3.050 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)NCC1(c2ccccc2)CCC1 159412636 RIMQZTPMUWPELB-RHSMWYFYSA-N 299.414 3.230 70 20 CGID CC1(C)CCC[C@@H]1NC(=O)NCC1(C2CC2)CC1 159468703 RNRUDRYPQDKQCH-LBPRGKRZSA-N 250.386 3.055 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)c1ccc(OC)c(F)c1 159668937 SFZZIUUVAJEFLF-IAQYHMDHSA-N 265.328 3.233 70 20 CGID CNC(=O)c1ccc(NC(=O)Nc2cscc2C)cc1 159940390 YOFURQAQZICZQS-UHFFFAOYSA-N 289.360 3.060 70 20 CGID CCCN(CCC)C(=O)NCc1ccc(OCC)cc1 217300942 VSMQTJSKROEGBS-UHFFFAOYSA-N 278.396 3.417 70 20 CGID CN1CCN(CCOc2ccccc2)[C@@H](c2ccccc2)C1 216734326 VWPDVFKUJKSRSZ-LJQANCHMSA-N 296.414 3.054 70 20 CGID CCC(CC)[C@@H](O)CNC(=O)c1cc(C)cc(Cl)c1 218064166 PDFMXOSIWURHLF-AWEZNQCLSA-N 283.799 3.175 70 20 CGID CCC[C@@H](N[C@H](C)c1cccc(OC)c1)C(=O)OCC 216632983 PWISGUXYQLSVAG-IUODEOHRSA-N 279.380 3.078 70 20 CGID C[C@H](c1ccc(F)cc1)N1CCN(Cc2ccncc2)CC1 161193352 LJGSVYBAGJBDMD-OAHLLOKOSA-N 299.393 3.100 70 20 CGID COc1ccc(CN2CC[C@H]3CC[C@H](C2)N3C)cc1Cl 160119305 GJADGBFVSLVONQ-ZIAGYGMSSA-N 294.826 3.017 70 20 CGID C[C@H](Nc1nnc(C(F)(F)F)s1)c1cccnc1 160320424 IPXYKXGTCFESAY-LURJTMIESA-N 274.271 3.125 70 20 CGID CCN(Cc1nccn1C)[C@@H](C)c1cccc(OC)c1 160786854 GPRSDTHPHCVCDV-ZDUSSCGKSA-N 273.380 3.012 70 20 CGID CC(C)n1cccc1-c1nc(-c2ccncc2)no1 160864548 XNUSWGXBLBXIKD-UHFFFAOYSA-N 254.293 3.181 70 20 CGID Cc1cc(C)cc(CCN[C@H](C)C2CCOCC2)c1 159517668 NCXYIRMEVSQOLZ-OAHLLOKOSA-N 261.409 3.251 70 20 CGID CS[C@@H]1CCC[C@@H](NC(=O)CCCn2cccc2)C1 159588315 JEWNLXPMSJSRKS-ZIAGYGMSSA-N 280.437 3.059 70 20 CGID CCCn1nccc1CN[C@@H](C)c1ccc(F)cc1F 160015374 HSTHQRFIXACOMH-NSHDSACASA-N 279.334 3.422 70 20 CGID C[C@@H](CN[C@H](C)c1ccco1)N(C)Cc1ccccc1 160876292 LCEKSWFGMVROKQ-LSDHHAIUSA-N 272.392 3.451 70 20 CGID CC(C)N(CCS[C@@H](C(N)=O)c1ccccc1)C(C)C 161071317 ZMNKSLAVPKZTTH-OAHLLOKOSA-N 294.464 3.065 70 20 CGID CC(C)(C(=O)N1CCC[C@H](c2ccn[nH]2)C1)C1CCCC1 161251465 OPRSPMVRBPZKES-ZDUSSCGKSA-N 289.423 3.332 70 20 CGID C[C@@H]1C[C@@H](C)CN(C(=O)COc2ccc3[nH]ccc3c2)C1 160074392 VBLMJMTXVJGAQC-CHWSQXEVSA-N 286.375 3.051 70 20 CGID CCC1(CNC(=O)NC[C@@H](C)SC)CCCC1 160400041 ZRFGVMYZYRXCHQ-LLVKDONJSA-N 258.431 3.008 70 20 CGID CC(C)C[C@@H](C)NC(=O)NCc1nc(C2CC2)cs1 160634241 CKUMJPQMBCGAAF-SNVBAGLBSA-N 281.425 3.254 70 20 CGID COc1ccc(CS[C@@H](C)CO)cc1Br 160781958 PBPKHKZIAZIRER-QMMMGPOBSA-N 291.210 3.072 70 20 CGID Cc1ccc(C(=O)N2CCC(N[C@@H](C)C(C)C)CC2)cc1 160980796 MZMFAFGKMVTPID-HNNXBMFYSA-N 288.435 3.234 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](C)c2cnn(C)c2)C1 159408056 PWVKXXAVUWFKHC-IACUBPJLSA-N 267.442 3.135 70 20 CGID CCCC(C)(C)NC(=O)c1cc2c(cc1F)NC(=O)CC2 159610023 YBPFIIHGSJIWSW-UHFFFAOYSA-N 292.354 3.019 70 20 CGID COCCn1ccc(N[C@@H](C)c2ccccc2C)n1 159639358 ZSVGZEURISYWTO-ZDUSSCGKSA-N 259.353 3.011 70 20 CGID Cc1cc(C)c2nc(NC(=O)[C@@H]3CCCCO3)sc2c1 159383325 PFUDSOCTEHWATQ-NSHDSACASA-N 290.388 3.421 70 20 CGID Cc1ccc(CCNC(=O)NCc2cccc(C)c2)cc1 217307935 XTEFLDFDMMKWTQ-UHFFFAOYSA-N 282.387 3.345 70 20 CGID COc1ccc(NC(=O)[C@H](C)CC2CCCC2)cc1N 161136477 HEQHAWCJOQMVHN-LLVKDONJSA-N 276.380 3.432 70 20 CGID C[C@@H]1CN(C(=O)Nc2ccc(Cl)nc2)CC[C@H]1C 160010928 GRXPZBUUZLYWKT-NXEZZACHSA-N 267.760 3.245 70 20 CGID CCCc1noc(CSCCc2c(C)noc2C)n1 160125864 MFQKXMWTQYWCNG-UHFFFAOYSA-N 281.381 3.103 70 20 CGID CC(C)NC(=O)N[C@H](C)Cc1ccccc1Br 160162795 PZHSWJUFLVVHSN-SNVBAGLBSA-N 299.212 3.088 70 20 CGID CCCC1(CNC(=O)c2ccc(C(C)=O)cc2)CC1 160622437 IQNOJMTYSHNPMN-UHFFFAOYSA-N 259.349 3.199 70 20 CGID Cc1ncc([C@@H](C)NC[C@@H]2CCc3ccccc32)c(C)n1 160970639 LJTANHGQIMEIGJ-WBMJQRKESA-N 281.403 3.474 70 20 CGID CC[C@H](C)OCC(=O)Nc1ccc(N2CCCC2)c(F)c1 159697453 QLIIADBYVTXLGF-LBPRGKRZSA-N 294.370 3.180 70 20 CGID C=CC[Si@]1(Cl)O[C@@H](c2ccccc2)[C@H](C)N1C 1857776903 XHCRAANIMMYPDV-XTQGRXLLSA-N 267.832 3.442 70 20 CGID NC(=O)Cc1ccc(NCc2ccc(Cl)cc2F)cc1 160734208 XBEOCQIDNFMQFG-UHFFFAOYSA-N 292.741 3.119 70 20 CGID C[C@H](CCc1ccccc1)N[C@H]1CCN2CCCC[C@@H]12 217678582 HXKKLKHUIQDGGZ-NJAFHUGGSA-N 272.436 3.224 70 20 CGID O=C(Nc1cccnc1)N[C@@H]1CCCc2sccc21 161166450 WECUKAHWAWXXPH-GFCCVEGCSA-N 273.361 3.342 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)[C@@H](C)C(C)C)o1 161406271 BPXWKZNWVXFCBX-GXTWGEPZSA-N 279.380 3.382 70 20 CGID COc1ccc(N(C)C(=O)c2ccncc2)cc1Cl 160041974 AWIGTRVEARMTMR-UHFFFAOYSA-N 276.723 3.020 70 20 CGID Cc1cccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c1F 160152980 KAFWZYOPTMRGIZ-CYBMUJFWSA-N 291.366 3.356 70 20 CGID CN(Cc1ccn(C)c1)Cc1ccccc1Br 160381275 OLVLEKTZRKKBHC-UHFFFAOYSA-N 293.208 3.420 70 20 CGID O=C(CCc1cccnc1)N[C@@H]1CCCc2sccc21 159827781 MCFNEQAXOLONHS-CQSZACIVSA-N 286.400 3.270 70 20 CGID CCOC[C@@H]1CCCN(CCC(=O)c2ccc(C)cc2)C1 159677298 VRCYKESFRIEUEO-MRXNPFEDSA-N 289.419 3.316 70 20 CGID CCCC(=O)Nc1cccc(CN[C@H](C)c2cnccn2)c1 159897326 NDQIOTODHJQTMQ-CYBMUJFWSA-N 298.390 3.066 70 20 CGID O=C(C[C@@H]1C=CCC1)NCCc1cc2ccccc2[nH]1 159501007 LUQIUWDRMKJAFZ-CYBMUJFWSA-N 268.360 3.183 70 20 CGID C[C@H](N[C@@H]1CCOC(C)(C)C1)c1ccc(-n2ccnc2)cc1 159933715 JKPFUKNUCVAVFO-GOEBONIOSA-N 299.418 3.481 70 20 CGID Clc1ccc(CN(CCn2ccnc2)C2CC2)cc1 159760139 LEYZAPOCYVQAAM-UHFFFAOYSA-N 275.783 3.201 70 20 CGID Cc1ccc(CN(CCn2ccnc2)C(C)C)s1 159775855 DBDLZHZUXPKUGG-UHFFFAOYSA-N 263.410 3.164 70 20 CGID Cc1ccccc1C1(C(=O)NCC(C)(C)N)CCCCC1 159974488 JFYGNVYPGBEHLT-UHFFFAOYSA-N 288.435 3.050 70 20 CGID CC1(C)C[C@H](NCc2cc3ccccc3o2)CCO1 160462354 LJJXJMMTMKFYRB-CYBMUJFWSA-N 259.349 3.480 70 20 CGID Cc1cccc(C(=O)N2CC=C(C(F)(F)F)CC2)c1F 160574282 FOTFKFSRMHIFOL-UHFFFAOYSA-N 287.256 3.469 70 20 CGID CN(C)c1ccc(NC(=O)N(C)c2ccccc2)cc1 217311413 VYBLLJZBJNASIM-UHFFFAOYSA-N 269.348 3.421 70 20 CGID C[C@H](N[C@H](C)c1cnn(Cc2ccccc2)c1)C1CC1 160137045 QIVCIKOLBWHXHU-UONOGXRCSA-N 269.392 3.381 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)cc1F 161022818 LLJCXDISAOAFLS-ZFWWWQNUSA-N 292.354 3.213 70 20 CGID COc1ccc(NC(=O)[C@H]2C[C@@H]2C2CCCCC2)cc1N 161030193 MPGDBPUBBORLGY-KGLIPLIRSA-N 288.391 3.432 70 20 CGID CCN(Cc1cnn(C)c1)Cc1cc(-c2ccccc2)no1 161109503 DZJXFHHZGYWCQU-UHFFFAOYSA-N 296.374 3.097 70 20 CGID C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)C[C@H]1C=CCC1 161244896 LMCLRFMXRUNUAH-OLZOCXBDSA-N 289.350 3.260 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccccn1 160374402 ZVYWWJWVJXMSIY-QWRGUYRKSA-N 258.346 3.194 70 20 CGID CCc1ccc([C@H](C)N[C@H](CCO)CSC)s1 160409557 LQIXCQWRSPEUQE-WDEREUQCSA-N 273.467 3.075 70 20 CGID Cc1cccc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H](N)C2)c1C 160720890 ZKQASOMWHLUKJW-VYDXJSESSA-N 286.419 3.094 70 20 CGID CC[C@H](NC(=O)[C@H]1C[C@@]1(C)CC)c1c(C)noc1C 160777264 WHIRBHJGVBVWNQ-TYNCELHUSA-N 264.369 3.295 70 20 CGID CC(C)(CO)CCCNc1nc(C(C)(C)C)ns1 159618052 OMFBEYPPVYQTFL-UHFFFAOYSA-N 271.430 3.046 70 20 CGID CC(C)Oc1cccc(CNCC2(CO)CCCC2)c1 160078183 SHDDCZOBNSIKCN-UHFFFAOYSA-N 277.408 3.116 70 20 CGID CCCCCC[C@@H](C)OCCCS(=O)(=O)Cl 112155295 PDFJLDFNAAMTNZ-LLVKDONJSA-N 270.822 3.321 70 20 CGID CC(C)C(=O)NCCCN[C@H](C)c1ccccc1Cl 159978896 QDHRDGUOJCDVBF-GFCCVEGCSA-N 282.815 3.153 70 20 CGID C[C@H](CCc1ccc(OC(F)F)cc1)S(=O)(=O)Cl 310333791 MYKZJPQLRMDTGO-MRVPVSSYSA-N 298.738 3.178 70 20 CGID CCc1noc(C)c1C[S@](=O)c1ccccc1C 161065900 XGHPPKCEYZDAJX-GOSISDBHSA-N 263.362 3.162 70 20 CGID CC1=C(C(=O)N2CCC[C@H]2c2ccccc2)CCCO1 161271067 MBVBFEFCOMKFDZ-INIZCTEOSA-N 271.360 3.435 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)NCCC1=CCCC1 161453976 ZFOAGDLXAJNXDF-NSHDSACASA-N 276.380 3.402 70 20 CGID Cc1cccc(CCNC(=O)Nc2ccnn2C(C)C)c1 160016965 IAYVTGZFOBBHPC-UHFFFAOYSA-N 286.379 3.137 70 20 CGID CC[C@@H](NC(=O)[C@@H]1CC1(C)C)c1ccc2c(c1)OCCO2 160036931 OHBJRGPCNCPEIP-QWHCGFSZSA-N 289.375 3.071 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)N(CC(F)F)C(C)C 160511328 NYDQLAGFWJJHGK-SECBINFHSA-N 288.338 3.287 70 20 CGID Cc1cc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)nc(C)n1 160528949 NJTMZGSOXWXYTN-HZPDHXFCSA-N 283.375 3.426 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)C[C@@H]1C=CCC1 160870794 OYPFQNNVKLYRKY-NWDGAFQWSA-N 277.389 3.182 70 20 CGID COc1ccc2cccc(CC(=O)Nc3nocc3C)c2c1 160950893 QTZNVNGZMLPEAN-UHFFFAOYSA-N 296.326 3.326 70 20 CGID CO[C@@]1(C)C[C@@H](N(C)C(=O)c2cc(C(C)C)on2)C1(C)C 159748016 KZDUMBHLSJECLB-CJNGLKHVSA-N 294.395 3.074 70 20 CGID COC[C@H](NC(=O)Nc1cc(F)ccc1Cl)C1CC1 159977832 JCCFKNKBEBABLL-LBPRGKRZSA-N 286.734 3.026 70 20 CGID CCCCCNC(=O)NCCCOc1ccccc1C 217300371 MUZHROHXLJXICF-UHFFFAOYSA-N 278.396 3.253 70 20 CGID COc1ccc(NC(=O)C[C@H]2CC[C@@H](C)C2)cc1N 161248982 POBFBBAMAOZFLM-MNOVXSKESA-N 262.353 3.042 70 20 CGID Cc1nc(CC(=O)NCc2ccc(C)c(F)c2)c(C)s1 160291420 MKNHMQODVYPBDB-UHFFFAOYSA-N 292.379 3.066 70 20 CGID CC(C)c1ccc(OCCN[C@H](C)[C@@H]2CCOC2)cc1 160329132 XFUDZILLZUGMGG-GDBMZVCRSA-N 277.408 3.203 70 20 CGID CN(Cc1cccc(F)c1)Cc1cccc2cn[nH]c12 160461965 TZXJDGLKCHICQQ-UHFFFAOYSA-N 269.323 3.334 70 20 CGID Cc1ccc2cc(C(=O)N3C[C@@H](C)OC(C)(C)C3)ccc2n1 160489940 FBVTXKBKTGFNOE-CYBMUJFWSA-N 298.386 3.183 70 20 CGID CCOCCC1(C(=O)Nc2cccc(F)n2)CCCC1 160890528 OJDUXTJMADNVRI-UHFFFAOYSA-N 280.343 3.146 70 20 CGID C[C@H]1CCC[C@@H](C)CN1C(=O)c1cccc2[nH]cnc12 159677041 FCQKZVNPMBOCCS-NEPJUHHUSA-N 271.364 3.214 70 20 CGID CC(C)n1nccc1C(=O)N1CCC[C@@H]1C1CCCC1 159532483 FFZKYNWLACZJMF-CQSZACIVSA-N 275.396 3.259 70 20 CGID CC(C)CC[C@H]1CCCN1C(=O)NCCc1cscn1 159569405 KFZFONAHYZIUDJ-CQSZACIVSA-N 295.452 3.296 70 20 CGID CCc1noc(C)c1CNc1ccc(C)c(NC(C)=O)c1 159398209 KRNPUZNWGKJVCF-UHFFFAOYSA-N 287.363 3.424 70 20 CGID C[C@H](C[C@H]1CCCCCN1)N[C@H](C)c1ccccn1 160823466 LCSOLYFWSSTYCE-RBSFLKMASA-N 261.413 3.043 70 20 CGID CNC(=O)c1cccc(NCc2ccc(F)cc2Cl)c1 161244148 QARWFXIVOFZBQQ-UHFFFAOYSA-N 292.741 3.451 70 20 CGID O=C(Nc1ccc(F)c(F)c1)N[C@H]1CCO[C@H](C2CC2)C1 161002537 KPVOFNKQPPVLBL-FZMZJTMJSA-N 296.317 3.044 70 20 CGID CCC[C@@H](C)C(=O)Nc1ccccc1-c1nc(CC)n[nH]1 161067561 AUNGCBJOQVQFFG-LLVKDONJSA-N 286.379 3.409 70 20 CGID Cc1cc(NC(=O)C[C@H](C)c2c(C)noc2C)ccc1O 161108450 CJELZCCVSKSMDN-JTQLQIEISA-N 288.347 3.438 70 20 CGID CCOC(=O)NCCCC(=O)Nc1c(C)cccc1CC 160067179 SFWUOMRSPAZWOK-UHFFFAOYSA-N 292.379 3.022 70 20 CGID Cc1cc(F)c(C(=O)NCCc2cccc(F)c2)cc1F 160171923 XFGDOPGLOXNXRP-UHFFFAOYSA-N 293.288 3.385 70 20 CGID CCC[C@@H](N[C@H](CCO)CSC)c1ccc(OC)cc1 160185435 UWYSVYIDRQKBMT-GDBMZVCRSA-N 297.464 3.240 70 20 CGID CC(C)(C)CCC(=O)N[C@H]1CCc2c(O)cccc21 160229859 ARLDRTQOKJOAGW-ZDUSSCGKSA-N 261.365 3.322 70 20 CGID CC(C)c1ccc(OCCN[C@H]2CCN(C)[C@H](C)C2)cc1 160326470 IRCIGAFNDRJOBH-WBVHZDCISA-N 290.451 3.261 70 20 CGID Cc1noc(C)c1N(C)C(=O)Cc1ccc(F)cc1Cl 160954613 SXFFLBNTWRFJGA-UHFFFAOYSA-N 296.729 3.289 70 20 CGID CCN(CCNC(=O)C[C@@H](C)SC)c1ccccc1C 159361923 XLYARPUPVFFAAW-CQSZACIVSA-N 294.464 3.079 70 20 CGID CCOCCCN(C)[C@H](C)c1cc(F)ccc1F 159366284 IIACLUWEBSKXDM-LLVKDONJSA-N 257.324 3.384 70 20 CGID Cc1ccccc1CCCN(C)C[C@H]1CCC[C@@H]1O 159552818 CWHDWJHRDVDHIW-SJORKVTESA-N 261.409 3.020 70 20 CGID CC[C@@H](C(=O)NCC(C)(C)c1ccc(Cl)cc1)N(C)C 159387184 WYNOCZGMPCJLTI-AWEZNQCLSA-N 296.842 3.074 70 20 CGID Fc1ccc(F)c(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159606517 HOAVZTVNKSFAQD-YUELXQCFSA-N 279.330 3.012 70 20 CGID CO[C@@H]1CCCC[C@H]1N[C@@H](C)c1cccc(NC(C)=O)c1 217951606 HQMQUNBVDHUSKB-JCURWCKSSA-N 290.407 3.253 70 20 CGID C[C@H](c1ccccc1F)N(C)CCOCC1CC1 159361538 NXAAXGNGMDEFIU-GFCCVEGCSA-N 251.345 3.245 70 20 CGID O=S(=O)(Cl)CCCCCCOC1CCCC1 112155095 VTHBTFGGROENSM-UHFFFAOYSA-N 268.806 3.075 70 20 CGID CCC[C@@H](CC)NC(=O)Nc1cc(C(=O)OC)cs1 161059841 HDNODOHCNFYHLB-SNVBAGLBSA-N 284.381 3.235 70 20 CGID C[C@@H](NC(=O)N1CCc2c(F)cccc2C1)c1cccnc1 161186050 XEKVIKVKBRNRCC-GFCCVEGCSA-N 299.349 3.050 70 20 CGID Cc1ccccc1-c1csc(=O)n1Cc1nccs1 161344522 ZUKSLAFTOJHBGK-UHFFFAOYSA-N 288.397 3.390 70 20 CGID CN(C(=O)c1coc2ccccc12)c1ccc2c(c1)OCO2 160338582 BHWUKYZLCRIBHA-UHFFFAOYSA-N 295.294 3.438 70 20 CGID CCc1nc(CN[C@H](c2cccc(F)c2)C(C)(C)C)n[nH]1 160483983 VWXWUAJGKADUPZ-OAHLLOKOSA-N 290.386 3.383 70 20 CGID CCCCn1ncc(C(=O)Nc2cccc3cn[nH]c23)c1C 160661324 WYWBEJANDFSOBA-UHFFFAOYSA-N 297.362 3.120 70 20 CGID CCc1nc2cc(NC(=O)NC3CC=CC3)ccc2o1 160822890 AARCNMMLMFXVSZ-UHFFFAOYSA-N 271.320 3.230 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H](C)CC)n1 160942717 DXJHOWIRZPYTRX-JTQLQIEISA-N 272.352 3.019 70 20 CGID CCCN(C(=O)Nc1ccnc(C)c1Cl)C1CC1 159679410 VTTWCOMEFLTQPD-UHFFFAOYSA-N 267.760 3.450 70 20 CGID CC[C@H](O)[C@H]1CCCCN1CCC(=O)c1ccc(C)cc1 159763562 BDEHNURFLMUXKD-SJORKVTESA-N 289.419 3.193 70 20 CGID CC1(C)C[C@@H]1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159572850 HXFIFHVXRJLYPE-IMJJTQAJSA-N 287.403 3.317 70 20 CGID Cc1ccc2c(c1)[C@H](NC[C@H]1CCCC[C@@H]1O)CC2 160584300 FGVIPIKAZAHIBE-OIISXLGYSA-N 259.393 3.123 70 20 CGID Cc1cccc([C@H](C)NS(=O)(=O)CCC(C)C)c1C 217215199 IWCVSJLJOPSGPL-AWEZNQCLSA-N 283.437 3.330 70 20 CGID COc1ccc(CN(C)Cc2ccc(C)o2)c(OC)c1 160830878 DBDOYWYDGRSGQI-UHFFFAOYSA-N 275.348 3.237 70 20 CGID CC(C)COCCCNCc1cccc2cc[nH]c12 218081229 IJRJTTJOPXHZCZ-UHFFFAOYSA-N 260.381 3.320 70 20 CGID CCc1nnsc1C(=O)N(C)[C@H]1CCCC[C@H]1CC 161041181 WQNBSKFGXXPAHT-PWSUYJOCSA-N 281.425 3.141 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccc(Cl)s1 161201225 MXAUGWIKYPLPIW-BDAKNGLRSA-N 273.785 3.148 70 20 CGID O=C(c1cccc(NCc2ccco2)c1)N1CCCC1 160057578 QTKPMTXXOSUNMA-UHFFFAOYSA-N 270.332 3.128 70 20 CGID CCO[C@H]1C[C@@H](NCC2(CO)CCCC2)C12CCCCC2 160101151 RFFKCYZCHQYASM-CVEARBPZSA-N 295.467 3.257 70 20 CGID CCCCOCCCNCc1nn(CC)c2ccccc12 160295398 ACIPSGZAQMQJBU-UHFFFAOYSA-N 289.423 3.353 70 20 CGID Brc1cncc(N[C@@H]2CCO[C@@H](C3CC3)C2)c1 160349005 TUDQMDLIDNLNEV-DGCLKSJQSA-N 297.196 3.214 70 20 CGID CN(CCc1nccs1)C(=O)Nc1cc(F)cc(F)c1 160451442 SPYDJZRZFUXFSI-UHFFFAOYSA-N 297.330 3.128 70 20 CGID CN(Cc1cccc(N(C)C)c1)C(=O)Nc1ccsc1 160503590 XYXMZIZWSGUNEY-UHFFFAOYSA-N 289.404 3.478 70 20 CGID CNC(=O)c1cnc(/C=C/c2cccc(Cl)c2F)s1 160717283 MAHSGOGIWSROPX-AATRIKPKSA-N 296.754 3.466 70 20 CGID COC[C@H](NC(=O)NCc1ccc2ccccc2c1)C1CC1 159442599 GQQRDFOCTDABJN-KRWDZBQOSA-N 298.386 3.064 70 20 CGID CCOc1ccc([C@@H](C)N[C@H](COC)C2CC2)cc1OC 159978914 CFSKSFKGYVVIQV-IUODEOHRSA-N 293.407 3.170 70 20 CGID CC[C@H](NCCCNC(=O)C(C)C)c1ccc(F)cc1F 159982500 XMLFUDFFKPNCMT-HNNXBMFYSA-N 298.377 3.168 70 20 CGID CC1CCC(NC(=O)[C@H](C)N[C@@H]2CCCC[C@@H]2C)CC1 218720411 LDUUURGAHNAECK-BEBHXBEKSA-N 280.456 3.238 70 20 CGID Cc1cccc([C@@H]2CCCN2CCc2ccccn2)n1 159752103 RDRUIIGUJSAPPH-KRWDZBQOSA-N 267.376 3.165 70 20 CGID O=S(=O)(Cl)C1=Cc2ccc(Cl)c(Cl)c2OC1 100645358 DMZLZUSKAUPVKF-UHFFFAOYSA-N 299.562 3.295 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)c2ccc3[nH]cnc3c2)C1 161214159 DBWUPVDTDSUGHG-ZDUSSCGKSA-N 285.391 3.461 70 20 CGID CS[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1Cl 161310643 BAAHPKDPQURDCO-MNOVXSKESA-N 285.840 3.386 70 20 CGID CN(C(=O)C(C)(C)c1ccccc1)c1ccc2c(c1)OCO2 160464472 YYHIIKWHECOYJP-UHFFFAOYSA-N 297.354 3.356 70 20 CGID CSc1cc(C(=O)N[C@@H](C)C[C@H]2CCCO2)ccc1F 160837619 IUBRBOZNPWHXSB-CMPLNLGQSA-N 297.395 3.235 70 20 CGID Cc1nc(COC(=O)CCc2ccsc2)c(C)s1 159431280 HKOZZBXEBHTBLY-UHFFFAOYSA-N 281.402 3.497 70 20 CGID CC1CCN(C(=O)N[C@@H]2CCCc3cc(N)ccc32)CC1 159445998 RILMFGDHYZNNGB-MRXNPFEDSA-N 287.407 3.088 70 20 CGID Cc1ccccc1[C@H](NC(=O)CCNC(C)C)C(C)C 159689401 DWYKDCKQSIYZLX-QGZVFWFLSA-N 276.424 3.196 70 20 CGID NC1(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)CCCCC1 159723828 MYLYGCXPLDNEJD-JKSUJKDBSA-N 286.419 3.101 70 20 CGID CCCCCNC(=O)[C@@H](C)N[C@@H](C)c1cccc(F)c1F 159532994 NSQWOKIPXBAADP-NWDGAFQWSA-N 298.377 3.310 70 20 CGID Cc1cccc(C(=O)N[C@@H]2CCCc3cc(N)ccc32)c1 159365113 OLXNARXRPZZCOW-QGZVFWFLSA-N 280.371 3.385 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)c2ccccn2)C1 159584743 OLZSRJRIAFRDQX-LBPRGKRZSA-N 284.384 3.470 70 20 CGID Cc1cccc([C@@H]2CCCN2CC(=O)Nc2ccccc2)n1 159795678 HQIFMNDUXWXJKH-KRWDZBQOSA-N 295.386 3.166 70 20 CGID CC[C@@H](N[C@H](C)c1ccc(OC(C)C)cc1)C(=O)OC 159489586 JIEDODWTHFIJPB-IUODEOHRSA-N 279.380 3.076 70 20 CGID CCSCCN1CC[C@@H](c2ccc(OC)cc2)C1 160032931 DWRWYECFWMZJMU-CQSZACIVSA-N 265.422 3.238 70 20 CGID FC(F)(F)c1cccc(N[C@H]2CCN3CCCC[C@@H]23)n1 217389099 LVYDYAQFWWPREO-QWRGUYRKSA-N 285.313 3.139 70 20 CGID Cc1cc(C(=O)CN2CCC[C@H]3CCCC[C@H]32)c(C)[nH]1 217811252 YTHAMVGEDWGTAY-GDBMZVCRSA-N 274.408 3.469 70 20 CGID CCN(Cc1ccccn1)[C@@H](C)C(=O)Nc1ccccc1C 161074579 WPDLYYRRKBEOEY-HNNXBMFYSA-N 297.402 3.239 70 20 CGID Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)CCNC(C)C)C1 161290232 PXTLFUZGHCQTJU-HZPDHXFCSA-N 288.435 3.088 70 20 CGID CC[C@H](SC)c1nc(-c2cccc(C(=O)OC)c2)no1 161373485 SBSXEEALPNKNOX-NSHDSACASA-N 292.360 3.337 70 20 CGID CC[C@H]1CCCC[C@H]1NCc1cccc(C(=O)N(C)C)c1 161410518 GPWUUNNEPQUKNL-DOTOQJQBSA-N 288.435 3.447 70 20 CGID CCOCCC1(CNC(=O)N2CCC[C@@H]2C2CCC2)CC1 161424168 GHEOOLYMXYEEDT-OAHLLOKOSA-N 294.439 3.167 70 20 CGID CC(C)Oc1ncccc1NC(=O)C[C@@H](C)c1ccncc1 160075575 KAEQQQXPRNOZOQ-CYBMUJFWSA-N 299.374 3.396 70 20 CGID CCC1(CC)[C@@H](OC)C[C@H]1N[C@@H](C)c1cccnc1 160109735 PYSKPZJXSUEWBK-CFVMTHIKSA-N 262.397 3.326 70 20 CGID CSc1ccc(NC(=O)C[C@H](C)c2ccncc2)cn1 160370055 ADKKDTPGFQRQBS-NSHDSACASA-N 287.388 3.331 70 20 CGID CCc1cc(NC(=O)N2C[C@H](C)[C@@H]2c2ccccc2)n(C)n1 160423998 NHLAUFLFMTUQQH-BLLLJJGKSA-N 298.390 3.207 70 20 CGID CC(C)c1csc(CNC(=O)c2cc(F)ccc2O)n1 160580715 VKIWOEDDVKGHDS-UHFFFAOYSA-N 294.351 3.041 70 20 CGID CCC(CC)CNC(=O)N1CC[C@H](Nc2ccccc2)C1 160605408 XCOWIOWORAVKLK-INIZCTEOSA-N 289.423 3.319 70 20 CGID O=C(N[C@H](c1cccc(F)c1)C1CCCC1)[C@@H]1CCCO1 160806005 FURFMUANICDFAQ-HOTGVXAUSA-N 291.366 3.352 70 20 CGID CCC(CC)(CC)NC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 160894165 GVJAUDVCUYGLII-MJBXVCDLSA-N 294.439 3.212 70 20 CGID Cc1ccc(NC(=O)N[C@H](C)C2CCC2)c(F)c1 159440281 PNPOOLANUHICHW-SNVBAGLBSA-N 250.317 3.444 70 20 CGID Cc1c(C(=O)NCC2(N)CCCCC2)oc2ccccc12 159757263 RRMXCRUFBZDPIR-UHFFFAOYSA-N 286.375 3.133 70 20 CGID CC[C@H](N[C@@H](C)c1ccc(OC(C)C)cc1)C(=O)OC 159489273 JIEDODWTHFIJPB-WFASDCNBSA-N 279.380 3.076 70 20 CGID CC(C)[C@@H]1CCN(C(=O)C[C@H]2CNc3ccccc32)C1 159593194 NVGDTYKSYIJOFD-KGLIPLIRSA-N 272.392 3.090 70 20 CGID COCCOCCCCNc1nc2ccc(F)cc2s1 159555193 ABWQAYWFQLGGTQ-UHFFFAOYSA-N 298.383 3.291 70 20 CGID COC(=O)C[C@H](C)SCc1noc(C2CCCCC2)n1 159813613 RPCKLYAPOJQLSW-JTQLQIEISA-N 298.408 3.302 70 20 CGID Clc1nc(SC2CCCC2)c2[nH]cnc2n1 160189841 UXIGRWNZWBPVTL-UHFFFAOYSA-N 254.746 3.041 70 20 CGID c1sc(C2CC2)nc1CN(C[C@H]1CCOC1)C1CC1 161410551 NJWDCADJQLLJJI-LLVKDONJSA-N 278.421 3.021 70 20 CGID CC[C@H](c1ccncc1)N(C)CCCN1CCCCC1 161461177 FHADZRMHAIFIRH-QGZVFWFLSA-N 275.440 3.341 70 20 CGID CC(C)[C@H](CC(=O)N[C@H]1CCC[C@H](N)C1)c1ccccc1 161053625 OUWSCDSPTVHOEJ-ULQDDVLXSA-N 288.435 3.202 70 20 CGID N[C@@H]1CCCCCC[C@@H]1C(=O)N1CCC2(CCCCC2)C1 161196980 WZRVWNDVFHEKGV-JKSUJKDBSA-N 292.467 3.467 70 20 CGID CC1(C)CCC(CC(=O)NC[C@H]2CCCCO2)CC1 161259570 QEAKCVZJBZEMIQ-CQSZACIVSA-N 267.413 3.278 70 20 CGID Cc1nc(Cl)cc(NC[C@@H]2CCCN(CC(C)C)C2)n1 161290987 PSERDIRPCILGCL-ZDUSSCGKSA-N 296.846 3.218 70 20 CGID Cc1nc(C2(NCc3ccc(F)cc3F)CCCC2)no1 161368203 NVMWSGNUSJYARR-UHFFFAOYSA-N 293.317 3.215 70 20 CGID CC[C@@](C)(NCCCN1CCCCC1)c1nccs1 161433537 ZKXWHELOLMELNX-OAHLLOKOSA-N 281.469 3.234 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)COCC1CC1 160214171 RVLRWXXABSSZNW-LBPRGKRZSA-N 278.348 3.034 70 20 CGID C[C@@H](NCCOc1cccc(Cl)c1)C1CCOCC1 160264359 VUSLTZPYWPSPIP-GFCCVEGCSA-N 283.799 3.124 70 20 CGID CC(C)c1ccc(OCCN[C@@H]2CCN(C)[C@H](C)C2)cc1 160326252 IRCIGAFNDRJOBH-NVXWUHKLSA-N 290.451 3.261 70 20 CGID CCC(CC)n1ncc(C(=O)N2C[C@H]3CC[C@H]2C3)c1C 160721835 SGBXIUMEGCZZDI-JSGCOSHPSA-N 275.396 3.177 70 20 CGID CN(C[C@@H]1CCC[C@@H]1O)C(=O)NCCCCC(C)(C)C 160787007 JRGCXVMTAIGUHG-KBPBESRZSA-N 284.444 3.005 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cnn(C(C)(C)C)c1C 159644083 VCKIVHOYGBTHJE-GXTWGEPZSA-N 277.412 3.255 70 20 CGID CCCn1nccc1CNc1ccc2c(c1)CCC2 159962728 ATWMXCCBSKEXIA-UHFFFAOYSA-N 255.365 3.394 70 20 CGID O=C(OCc1cncs1)c1cc2c(s1)CCC2 159570204 KTHPPVPIFFJWGV-UHFFFAOYSA-N 265.359 3.050 70 20 CGID CCc1ccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)cc1 161016430 XJNNLSWYJVKYIY-CVEARBPZSA-N 288.391 3.328 70 20 CGID CCNC(=O)CN(C)c1ccc(Oc2ccccc2)cc1 161092566 KRSSYZHSAYXBAO-UHFFFAOYSA-N 284.359 3.051 70 20 CGID C[C@@H](c1ccc(F)cc1)N1CCN(Cc2ccncc2)CC1 161193238 LJGSVYBAGJBDMD-HNNXBMFYSA-N 299.393 3.100 70 20 CGID CCO[C@@H]1C[C@@H](N[C@@H](C)C2CCN(C)CC2)C1(CC)CC 161317890 WSEBVHXSAKEYBW-USXIJHARSA-N 296.499 3.290 70 20 CGID C[C@@H](CC(=O)N(C)[C@H](C)C1(C)CC1)c1ccncc1 161419100 SJUJUSIALIVUSG-QWHCGFSZSA-N 260.381 3.222 70 20 CGID COc1ccc(CNc2ccc(F)c(OC)c2)c(OC)c1 160018136 ZASGRKJSCPFDTI-UHFFFAOYSA-N 291.322 3.464 70 20 CGID Cc1ccc(-c2nnc(NC(=O)C[C@@H]3CC[C@H](C)C3)[nH]2)o1 160187935 IAKMATABNZKXMP-GXSJLCMTSA-N 288.351 3.138 70 20 CGID C[C@@H](NC[C@H](C1CCCCC1)N(C)C)c1cncs1 160400326 DFBNFTWJTUHQSE-TZMCWYRMSA-N 281.469 3.304 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](C)C2(C)CC2)c1 160627136 ASBOKYUUNXSGFY-ZDUSSCGKSA-N 274.408 3.105 70 20 CGID COc1cc(CNC(=O)N2CC[C@H](C)[C@@H](C)C2)ccc1C 160862619 NHGDSIIBELVBJO-JSGCOSHPSA-N 290.407 3.191 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(C)c(F)c1)[C@@H]1CCCO1 159418302 MKZFSGPPEKXGPA-KGLIPLIRSA-N 280.343 3.213 70 20 CGID Cc1ccccc1[C@@H](O)CNc1nc(C(C)(C)C)ns1 159445812 HAFRPYXHXGRNAX-LBPRGKRZSA-N 291.420 3.290 70 20 CGID COc1ccc(N(C)C(=O)c2cc(F)ccc2F)cc1F 159471390 QZBGABXVDKLJIV-UHFFFAOYSA-N 295.260 3.389 70 20 CGID Cc1ccc(CN(C)C)cc1N[C@H](C)CCn1cccn1 159473828 YBAFIAUSNCRPNX-OAHLLOKOSA-N 286.423 3.144 70 20 CGID CC(C)c1ccccc1NC(=O)N[C@H]1CC[C@H](O)CC1 159878725 UVAQMORQTGEURJ-BETUJISGSA-N 276.380 3.235 70 20 CGID COc1ccc(N(C)C(=O)C[C@H]2C=CCC2)cc1F 159553342 FVOMNKBIVGYEPI-NSHDSACASA-N 263.312 3.153 70 20 CGID COc1ccc(NC(=O)[C@@H]2CCC[C@@H](C)C2)cc1N 161255644 HPYKDDFBCOYBPP-GHMZBOCLSA-N 262.353 3.042 70 20 CGID Cc1cccc(C(=O)N(C)Cc2ccoc2C)c1F 161489051 GYYVSCMFKDSNCI-UHFFFAOYSA-N 261.296 3.308 70 20 CGID Cc1ccc(-n2ccnc2)c(C(=O)NCCC2=CCCC2)c1 160233832 CSIQTFSJYOKMRQ-UHFFFAOYSA-N 295.386 3.411 70 20 CGID CCCCCOCC(=O)N[C@@H](CC)c1c(C)noc1C 160297964 WJGKRRTUWZAUCZ-ZDUSSCGKSA-N 282.384 3.066 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCCO1)c1ccc(Cl)cc1 159943631 KEAIPKPPLSLCMB-ZWNOBZJWSA-N 267.756 3.086 70 20 CGID Cc1cnc([C@H](C)NC(=O)N[C@@H](C)CC(C)C)s1 159394412 FRIPOHYDSZTSRT-ONGXEEELSA-N 269.414 3.246 70 20 CGID CN(Cc1cccc2ccccc12)C[C@@H]1CCC[C@@H]1O 159499439 IFQNXTVKQWBXQT-WMZOPIPTSA-N 269.388 3.433 70 20 CGID COc1ccc(C)cc1[C@H](C)NCC1(CO)CCCC1 160068423 PXLVOOQLMWDPNZ-AWEZNQCLSA-N 277.408 3.207 70 20 CGID CS[C@H]1CCC[C@@H](NCc2ccccc2NC(C)=O)C1 160465836 KDLMHDFPPFWNNS-CABCVRRESA-N 292.448 3.409 70 20 CGID CO[C@@H]1CCCC[C@@H]1N[C@@H](C)Cc1ccc(F)cc1 217909154 GGJFKOKBPDAWLA-VBNZEHGJSA-N 265.372 3.304 70 20 CGID CCOC(=O)Nc1cccc(OCc2nccs2)c1 161142353 AAXXTTGPTVFGNW-UHFFFAOYSA-N 278.333 3.291 70 20 CGID Cc1ccc(F)c(OCC(=O)Nc2cc(Cl)ccn2)c1 161169816 GRSZQSAJWHQNSH-UHFFFAOYSA-N 294.713 3.200 70 20 CGID Cc1ccc(C(=O)NC[C@@H](C)Oc2ccccc2C)cc1N 161171816 URVGAPKHFBGVOO-CQSZACIVSA-N 298.386 3.083 70 20 CGID Cc1nc(-c2cccnc2)nc(Oc2ccc(F)nc2)c1C 161240249 QIWIVNACATWUJP-UHFFFAOYSA-N 296.305 3.482 70 20 CGID CCO[C@@H](CC)C(=O)N(C)c1ccc(OC)c(Cl)c1 160069724 XJFRCJPMWACVSX-LBPRGKRZSA-N 285.771 3.127 70 20 CGID CCOc1cc(C)ccc1NC(=O)/C=C/c1cnn(C)c1C 160381668 VIROBDNAIZTWGC-VQHVLOKHSA-N 299.374 3.088 70 20 CGID FC(F)CNCc1cccc(Br)c1Cl 160397639 PCOVCDNEHZCELF-UHFFFAOYSA-N 284.531 3.457 70 20 CGID Cc1ccc(NC(=O)C[C@@H](C)c2c(C)noc2C)cn1 160849792 WXCYTJDAJSFFNH-SECBINFHSA-N 273.336 3.127 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCOC(C)(C)C2)cc1F 160854734 JAZSWEJGVDJMHU-LBPRGKRZSA-N 280.343 3.213 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cccc2[nH]ccc12 159403644 HWBRXVVPEWYLKQ-CYBMUJFWSA-N 298.386 3.390 70 20 CGID CN(C)c1ccc(C(=O)N(C)c2ccc(F)cc2)c(F)c1 159653075 JTZRMFUFQZJFTR-UHFFFAOYSA-N 290.313 3.307 70 20 CGID CCc1cc(N[C@H]2CCCc3cc(N)ccc32)nc(C)n1 159496210 NZQSDNJLAKOWFU-INIZCTEOSA-N 282.391 3.419 70 20 CGID COC(=O)c1ccsc1NC(=O)C[C@H]1CC[C@@H](C)C1 159382505 LBDBFXCIOQOZSV-ZJUUUORDSA-N 281.377 3.300 70 20 CGID Cc1cc(C(=O)NCC(C)(C)N)c(C)n1C1CCCCC1 159990663 VIQYZNQZADCLBZ-UHFFFAOYSA-N 291.439 3.077 70 20 CGID C[C@@H]1CN(C(=O)NC[C@H]2CC=CCC2)CC[C@H]1C 161121820 XNTCVMZNDHVZKZ-MCIONIFRSA-N 250.386 3.030 70 20 CGID Cc1cc(C(=O)CN(C)[C@H]2CCC[C@@H](C)C2)c(C)[nH]1 218587248 VQLKKYIMNCOAJR-RISCZKNCSA-N 262.397 3.325 70 20 CGID C[C@H](CC(=O)N[C@@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCCNC1 161027906 VOEKJCJOSXGLKK-XLNGHYISSA-N 292.467 3.097 70 20 CGID CC(C)(Oc1cccc(Cl)c1)C(=O)NC1CC=CC1 161047805 RMJZCQHQECUSLF-UHFFFAOYSA-N 279.767 3.332 70 20 CGID CC(=O)NC1CCC(Nc2cc(C)ccc2C)CC1 161124174 DFKWEAGTMNZDRC-UHFFFAOYSA-N 260.381 3.163 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)NCc1ccc(Cl)cc1 161494320 MCHZGQQANYBBDB-QWRGUYRKSA-N 266.772 3.422 70 20 CGID C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@@H](C)C1 160309217 JPXOASKBTWTTMU-CLWVCHIJSA-N 294.439 3.022 70 20 CGID Cc1nc2ccc(NC(=O)N(C)[C@H]3CCSC3)cc2o1 160361667 PMNQSZFZCPRDNK-NSHDSACASA-N 291.376 3.105 70 20 CGID CCCC(O)(CCC)CC(=O)N(C)Cc1ccoc1C 160401829 FKKCIMYUYLTTEP-UHFFFAOYSA-N 281.396 3.268 70 20 CGID CCCCN(C)C(=O)CSc1nc(C(C)C)ns1 160698418 LSVSRNHZEJRAFZ-UHFFFAOYSA-N 287.454 3.012 70 20 CGID CC[C@@H](CC(=O)N[C@@H](CO)CC(C)C)c1ccc(C)cc1 160854399 LDTPNFGSVSJJIW-DOTOQJQBSA-N 291.435 3.402 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)Cc1cn(C)c2ccccc12 159637075 AYSRJMNMWAUBCE-CJNGLKHVSA-N 284.403 3.416 70 20 CGID CCC[C@@H](C)CC(=O)N[C@H]1CCOC2(CCCC2)C1 159662411 LAPFKBDZJBRPRF-KGLIPLIRSA-N 267.413 3.421 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@@H](C)C2CCC2)c1 159478626 TWJPFRCJMOZKAC-JTQLQIEISA-N 250.317 3.444 70 20 CGID CC[C@@H](C(=O)NCc1c(C)noc1C)c1ccc(F)cc1 159363867 YTYSCRWQAGPTQH-CQSZACIVSA-N 290.338 3.241 70 20 CGID Cc1cccc([C@@H](C)C(=O)N[C@H](C)CN2CCCCC2)c1 159754922 ZTKPQZHOAUBXHY-HZPDHXFCSA-N 288.435 3.089 70 20 CGID CC(C)(C)NC(=O)CN[C@@H](c1cccs1)C1CCCC1 159876423 AXZXAGGRECDMNQ-OAHLLOKOSA-N 294.464 3.484 70 20 CGID Cc1ccc(CCNC(=O)NCc2ccccc2C)cc1 217307933 VKQURLGAKZNOTG-UHFFFAOYSA-N 282.387 3.345 70 20 CGID CN(Cc1ccc(Cl)cc1)C[C@@H](O)Cc1ccccc1 218686478 FROUJDKLAZRKEU-KRWDZBQOSA-N 289.806 3.375 70 20 CGID CC[C@H](C)N(C)CCNc1nc2ccc(N)cc2s1 218729135 DTBQJWMCFZLQDA-JTQLQIEISA-N 278.425 3.021 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)C[C@@H]1C=CCC1 160103273 AFBPRJVYNKNPGV-DOMZBBRYSA-N 271.360 3.155 70 20 CGID Cc1cc(C)nc(NC[C@](C)(O)c2ccccc2Cl)n1 160166979 GOUUVDAZSPUGFF-HNNXBMFYSA-N 291.782 3.066 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCCc1cc(C)ccc1OC 160170204 IFEKKSGKAFMJPF-YOEHRIQHSA-N 275.392 3.099 70 20 CGID FC(F)Oc1ccc(N[C@H]2CCO[C@@H](C3CC3)C2)nc1 160275217 PFTRUODOCFKIAN-CMPLNLGQSA-N 284.306 3.053 70 20 CGID CCC(N)(CC)CNC(=O)CCc1ccc2ccccc2c1 160535864 VZPQILVFEPNFHQ-UHFFFAOYSA-N 298.430 3.406 70 20 CGID CC[C@H](NC(=O)CC[C@@H]1CCCCO1)c1c(C)noc1C 160712283 XKRSOJYKSQFDCA-KBPBESRZSA-N 294.395 3.208 70 20 CGID O=C(NC1CC=CC1)C1(c2cccc(Cl)c2)CC1 160856411 MCNNGCBXGYRATA-UHFFFAOYSA-N 261.752 3.206 70 20 CGID Cc1ccc(NC(=O)NCCCC(=O)OC(C)C)c(C)c1 160935372 FUYKSEGAJNYLCB-UHFFFAOYSA-N 292.379 3.157 70 20 CGID CC(C)[C@H](C)NC[C@@H](C)N1CCc2ccccc2C1 159801059 AIEPUUANOAXRBC-CABCVRRESA-N 260.425 3.067 70 20 CGID CCCCN(CCOC)C(=O)Nc1ccnc(C)c1Cl 159485816 DGKZFNVMUSDBNR-UHFFFAOYSA-N 299.802 3.324 70 20 CGID O=C(N[C@@H](C[C@H]1CCOC1)c1ccccc1)C1CC=CC1 159490822 ZTEHVDIHMUTVFB-PBHICJAKSA-N 285.387 3.237 70 20 CGID C[C@@H](N[C@@H]1CCOC(C)(C)C1)c1ccc(-n2ccnc2)cc1 159933867 JKPFUKNUCVAVFO-GDBMZVCRSA-N 299.418 3.481 70 20 CGID CN(CC1CCOCC1)C(=O)N[C@H]1CCCCC1(C)C 159938298 DXYKEXAWCDFILV-AWEZNQCLSA-N 282.428 3.023 70 20 CGID Clc1ccccc1[C@H]1CCCN1CCn1ccnc1 159764832 GPRHCIVUGOOZJE-OAHLLOKOSA-N 275.783 3.374 70 20 CGID Cc1cc(C(N)=O)ccc1NCc1cc(F)cc(Cl)c1 160856958 YNHAZWDVJRTYIH-UHFFFAOYSA-N 292.741 3.499 70 20 CGID CNC[C@@H]1CCCN([C@@H](C)c2ccc(OC(F)F)cc2)C1 218073170 NQYAYYLFCAMSJN-STQMWFEESA-N 298.377 3.280 70 20 CGID COC[C@@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)C1CC1 161251480 MJLIPRGKVMVBMQ-XHDPSFHLSA-N 295.810 3.060 70 20 CGID CC[C@@H](SC)c1nc(CC(=O)Nc2ccccc2)no1 161274819 DXCYIBZXVAGXDL-LLVKDONJSA-N 291.376 3.065 70 20 CGID CC(C)(C)C[C@H](CO)Nc1cnc2cc(F)c(F)cc2n1 161425269 SCROVHCILQVTQT-SECBINFHSA-N 295.333 3.117 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc2ccccc2n1 160080540 LPEJKBUIOKMXJX-UHFFFAOYSA-N 266.344 3.155 70 20 CGID C[C@@](O)(CNc1ccccn1)c1ccccc1Cl 160185412 CEFRPHZDUPWUFX-CQSZACIVSA-N 262.740 3.055 70 20 CGID CC(C)CN1C(=O)c2ccccc2N[C@@H]1c1ccn(C)c1 160228541 PAAYKZCSZKCBAV-INIZCTEOSA-N 283.375 3.248 70 20 CGID CCCc1ccc([C@@H](C)N[C@H](CCO)CSC)cc1 160252158 KZJXDDJRNJNGKW-CZUORRHYSA-N 281.465 3.404 70 20 CGID C[C@@H]1CN(C(=O)Nc2cccc(F)c2F)CC[C@H]1C 160466231 NQNHYBNZDKTLHG-NXEZZACHSA-N 268.307 3.475 70 20 CGID CCN(C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)C1CC1 160927147 FCFYNIZZFJEIHS-GDBMZVCRSA-N 288.391 3.101 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c(C)c1 160934287 NAEMHJUGDLDBRK-GDBMZVCRSA-N 288.391 3.383 70 20 CGID C[C@@H]1Cc2ccccc2N(C(=O)c2cccc3[nH]cnc23)C1 159416929 OMJMFAYJNWPPKM-GFCCVEGCSA-N 291.354 3.402 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H](CC)c2cnn(C)c2)C1(C)C 159766995 HODKWEBKEJUXJY-HRCADAONSA-N 293.455 3.445 70 20 CGID CC[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)C(=O)OC 159513852 FFSZZRJEONIMIV-JOYOIKCWSA-N 289.297 3.308 70 20 CGID CC(C)(C)C1=CCN(S(=O)(=O)c2ccc(F)cc2)CC1 160771232 RMSSDVCHQKCCBR-UHFFFAOYSA-N 297.395 3.193 70 20 CGID C[C@H]1CCCN(C(=O)NCC2C(C)(C)C2(C)C)C1 160670275 BABUPMPCAZXPGD-NSHDSACASA-N 252.402 3.110 70 20 CGID CC1CCN(C(=O)NC[C@@H]2CCC[C@H](C)C2)CC1 218051336 RFLYPWOIMBQUMY-UONOGXRCSA-N 252.402 3.254 70 20 CGID C[C@H](CC(=O)N[C@@H]1CCCC1(C)C)c1ccncc1 161294911 MBMLEZGVBFUWJU-TZMCWYRMSA-N 260.381 3.270 70 20 CGID CCCC(=O)N(CCC)[C@@H](C)C(=O)Nc1ccccc1 161442618 HLLJZCMKYVLYPE-ZDUSSCGKSA-N 276.380 3.052 70 20 CGID CC(C)CCC(=O)N[C@H]1CCOC2(CCCC2)C1 160181383 PUYPAVMAEQOFGM-ZDUSSCGKSA-N 253.386 3.031 70 20 CGID Cc1cc(NC(=O)[C@H](C)Cc2cccc(Cl)c2)no1 160344211 GVBRVTWDJJXNLX-SECBINFHSA-N 278.739 3.454 70 20 CGID C[C@@H](CO)N(C)C(=O)c1ccc(-c2ccc(F)cc2)s1 160466943 JKXSYYWAELPRGJ-JTQLQIEISA-N 293.363 3.007 70 20 CGID CN(CCC1CCOCC1)c1cc(C(F)(F)F)ccn1 160544889 HHMVVVWPFBEJCY-UHFFFAOYSA-N 288.313 3.353 70 20 CGID CCCC1(CNC(=O)c2cc(C(C)(C)C)nn2C)CC1 160610176 HAPMSEHRQPZOHJ-UHFFFAOYSA-N 277.412 3.028 70 20 CGID CS(=O)(=O)CCCCSCc1ccc(F)c(F)c1 160909498 SRMONRIXBBWULJ-UHFFFAOYSA-N 294.388 3.023 70 20 CGID CC[C@H](NC(=O)C1=CCCC1)c1ccc(OC)cc1 159496138 OCSLTRKSNXODDN-HNNXBMFYSA-N 259.349 3.373 70 20 CGID CC(C)(C)c1nsc(N2CCO[C@H](c3ccco3)C2)n1 159911001 RNXQCXDFZPJMJA-NSHDSACASA-N 293.392 3.007 70 20 CGID O=C(CCCOc1cccc(F)c1)NCC1(C2CC2)CC1 159778408 BXCACFBJYWSAQA-UHFFFAOYSA-N 291.366 3.291 70 20 CGID Cc1ccc2cc(C(=O)N(C)C[C@H]3CCCCO3)ccc2n1 159587036 QJKCUGRPKLBTSE-MRXNPFEDSA-N 298.386 3.184 70 20 CGID COc1cc(C)cc(OC)c1OCc1nccs1 161155839 BZMUJCHTYWDUDA-UHFFFAOYSA-N 265.334 3.048 70 20 CGID CC(C)C1CCN(C(=O)[C@H](C)[C@H](N)c2ccccc2)CC1 161268918 FWMDAZDAAJMDJR-PBHICJAKSA-N 288.435 3.217 70 20 CGID CN1CCC[C@H]2CN(C(=O)C3CCC(C)(C)CC3)CC[C@@H]21 161306612 VOWLTPNTNPWGNG-HOTGVXAUSA-N 292.467 3.146 70 20 CGID C[C@H](Cc1ccc(F)cc1)NC[C@@](C)(O)c1ccsc1 160014505 JHEIASYAXTUVBF-MLGOLLRUSA-N 293.407 3.316 70 20 CGID COc1ccc(F)cc1[C@H](C)NC(=O)C[C@H](C)SC 160083253 PGOPFCQPWJJYHD-UWVGGRQHSA-N 285.384 3.153 70 20 CGID CC[C@H](NC(=O)Nc1ccc(SC)cc1)[C@@H]1CCCO1 160116974 VWZKCDMMFLLDKS-KBPBESRZSA-N 294.420 3.488 70 20 CGID CC(C)[C@H](NC(=O)[C@@H]1CCCCO1)c1ccccc1 160232426 NYWDBUGYPAKWAG-GJZGRUSLSA-N 261.365 3.069 70 20 CGID Cc1cc(O)c(C(C)C)cc1NC(=O)[C@H]1CCCCO1 160262648 FKGPQNNLQCFESL-OAHLLOKOSA-N 277.364 3.332 70 20 CGID C[C@@H](CC(=O)NCCCOC1CCCC1)c1ccncc1 160279505 QFQIOLSYYAUEDL-AWEZNQCLSA-N 290.407 3.041 70 20 CGID CCc1nc(CN[C@H](C)c2ccc(OC(C)C)cc2)n[nH]1 160301466 WYSKUYXHDBORLN-GFCCVEGCSA-N 288.395 3.005 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)C1CCCC1 160471523 IBYSZXMSMDPANH-CQSZACIVSA-N 265.397 3.175 70 20 CGID CCN(CCCO)C(=O)c1ccc(-c2ccccc2)cc1 160504225 HGUDJRVDVQMARN-UHFFFAOYSA-N 283.371 3.198 70 20 CGID CCCC1(CNC(=O)c2ccc(CN(C)C)cc2)CC1 160562814 LDLWXUUUGIHSTG-UHFFFAOYSA-N 274.408 3.058 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cc(C)no1 160780527 PQXFVVSYHRYLKL-NEPJUHHUSA-N 250.342 3.024 70 20 CGID CC(C)Cc1ccc(CCC(=O)N(C)CC(C)(C)O)cc1 159629925 FLHVTISFSIVTOO-UHFFFAOYSA-N 291.435 3.047 70 20 CGID Cc1cc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)ccc1F 159532850 HOBOMRSTCUHFCX-BPUTZDHNSA-N 275.367 3.181 70 20 CGID COc1ccc2c(c1)C[C@H](NC[C@@H](C)C1CC1)CC2 159554981 FRFMRLAXCUBWIP-MLGOLLRUSA-N 259.393 3.188 70 20 CGID CCCC1(CN[C@H](C(=O)OC)c2ccccc2)CC1 160773975 ZQISVCHAOCNORN-AWEZNQCLSA-N 261.365 3.071 70 20 CGID Fc1cc(Cl)cc(CN2CCC([C@@H]3CCCN3)CC2)c1 161138252 KHYBAZMFKJPFDC-INIZCTEOSA-N 296.817 3.443 70 20 CGID CC(C)Sc1ccccc1NC(=O)[C@H]1CCCNC1 161398624 JQNOAYUXDFYZHW-LBPRGKRZSA-N 278.421 3.125 70 20 CGID CCC[C@H](NC1CCN(C)CC1)c1ccc(OC)cc1 161430116 IUQHICJMCXCQRS-KRWDZBQOSA-N 276.424 3.220 70 20 CGID CCOC(C)(C)CNc1cc(C(F)(F)F)ccn1 159542216 PNULGDGWXXZRKN-UHFFFAOYSA-N 262.275 3.327 70 20 CGID C[C@@H](CCCO)Nc1ncc(Cl)cc1Br 159613577 GPFHCVIXEJFYKG-ZETCQYMHSA-N 293.592 3.070 70 20 CGID CC1CCN(C(=O)NC[C@@H]2CCC[C@@H](C)C2)CC1 218051187 RFLYPWOIMBQUMY-ZIAGYGMSSA-N 252.402 3.254 70 20 CGID CCC[C@H](N[C@H](C)c1cccc(OC)c1)C(=O)OCC 216632936 PWISGUXYQLSVAG-DOMZBBRYSA-N 279.380 3.078 70 20 CGID COc1ccc(NC(=O)c2cc(C)n(C3CC3)c2C)cc1N 161215459 MFJSLQNELQBUEP-UHFFFAOYSA-N 299.374 3.283 70 20 CGID CC[C@H](NCCCOc1c(C)cccc1C)[C@@H]1CCOC1 161237163 XWXNVRIGADZVLK-SJORKVTESA-N 291.435 3.477 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc(C)n1 161284685 CQPXIRVDYCVSRR-UKRRQHHQSA-N 260.381 3.431 70 20 CGID C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cccs1 161289397 WBPHELSXHQCODJ-JTQLQIEISA-N 291.347 3.279 70 20 CGID Cc1noc(C)c1C(=O)N1CCc2c(Cl)cccc21 161468392 PTHAWKCBNNLWMW-UHFFFAOYSA-N 276.723 3.148 70 20 CGID Cc1noc(C)c1CCSCc1noc(C(C)(C)C)n1 160126324 SSVJISNOYSQZRP-UHFFFAOYSA-N 295.408 3.448 70 20 CGID CCC(CC)c1cc(C(=O)N(C)Cc2cc(C)on2)on1 160188371 NPHZUXUZNYOMFY-UHFFFAOYSA-N 291.351 3.147 70 20 CGID C[C@@H](C(=O)N[C@H]1CCOC2(CCCC2)C1)c1ccsc1 160256688 NWKTZVPHGQZAJO-OCCSQVGLSA-N 293.432 3.460 70 20 CGID CC(C)(C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160277842 HQKSPTVOOASSHK-LBPRGKRZSA-N 253.386 3.031 70 20 CGID Cc1ccc(C(=O)NCc2nc(C(C)C)cs2)c(O)c1 160579955 ZKVGGQMZEPMFNR-UHFFFAOYSA-N 290.388 3.211 70 20 CGID CC[C@@H](NCCCCc1nc(C)cs1)[C@@H]1CCOC1 160695248 FEPDJTVHCHHRAS-ZIAGYGMSSA-N 282.453 3.179 70 20 CGID CC(C)CCn1ccc(NC(=O)N(C)[C@H](C)C2CC2)n1 160731947 IFCNCCRXKFWXHL-GFCCVEGCSA-N 278.400 3.191 70 20 CGID NCCC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 160982158 VBJKNBZLTUWLNG-CQSZACIVSA-N 280.799 3.133 70 20 CGID CC(C)Oc1ccccc1CC(=O)NCC1(C2CC2)CC1 159871410 LOGSFOOXAUBGDC-UHFFFAOYSA-N 287.403 3.323 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)Oc1cccc(F)c1 159726300 PXDFVRGXDHDPCS-LALPHHSUSA-N 279.355 3.288 70 20 CGID C[C@@H](NC[C@@H](C)N(C)Cc1ccccc1)c1ccco1 160876409 LCEKSWFGMVROKQ-HUUCEWRRSA-N 272.392 3.451 70 20 CGID CC(C)(C)OC(=O)NOCc1ccc(Cl)cc1 218082657 ITWVEEBTMXTILF-UHFFFAOYSA-N 257.717 3.296 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc(F)cc1 217680717 HJDCDKXKPCABKR-RCBQFDQVSA-N 262.372 3.103 70 20 CGID COc1ccccc1CN(C)CCCCn1ccnc1C 161280244 LULHCWDUVAFXJA-UHFFFAOYSA-N 287.407 3.112 70 20 CGID C[C@@H](NCC1(CO)CCCC1)c1ccc(OC(F)F)cc1 160079787 HYEOKBJGORYJGV-GFCCVEGCSA-N 299.361 3.491 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)CCOc1ccccc1F 160236512 TVSCYIWCUOFZBI-WBMJQRKESA-N 279.355 3.099 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@H]2CCCCO2)C1 159640302 YIOZERAKDKZZQL-GXTWGEPZSA-N 291.416 3.331 70 20 CGID Cc1cc(N[C@@H](C)c2cc(F)ccc2F)nn1C 159650636 CVSCZCJEUPYMIG-VIFPVBQESA-N 251.280 3.180 70 20 CGID Cc1c(CN[C@@H](C)c2ccc(OC(F)F)cc2)cnn1C 159713301 YBOFAMQINZVVAS-JTQLQIEISA-N 295.333 3.181 70 20 CGID CC[C@@H](N[C@@H]1CCCSC1)c1ccc2c(c1)OCCO2 159556609 YGBSUAIOLFGNOK-ZIAGYGMSSA-N 293.432 3.394 70 20 CGID CC/C=C(/C)C(=O)N(C)CCOCc1ccccc1 159378700 MKFRQSRRXMVDIU-ZSOIEALJSA-N 261.365 3.018 70 20 CGID COC(=O)CCCC(=O)Nc1ncccc1-c1ccccc1 159791825 PSYUIPFWRAPRGB-UHFFFAOYSA-N 298.342 3.030 70 20 CGID CCCCOCCCNc1ccccc1S(=O)(=O)CC 160370305 HUFMLZMWHXCKEC-UHFFFAOYSA-N 299.436 3.099 70 20 CGID COC[C@H](C)NC(=S)NCCCCCCC(C)C 217764004 HZUZITNAFJCZKY-ZDUSSCGKSA-N 274.474 3.092 70 20 CGID CS[C@H](C)CC(=O)NCc1cc2ccccc2o1 159461163 LSGSEPAKSDAAME-SNVBAGLBSA-N 263.362 3.191 70 20 CGID CC[C@H](N)C(=O)Nc1ccc(COCc2ccccc2)cc1 161090250 FJOUORHHJOHCBY-KRWDZBQOSA-N 298.386 3.079 70 20 CGID COCCN(CC(C)C)C(=O)[C@H]1C[C@H]1c1sccc1C 161170572 BGGKANLLTCIEDU-KGLIPLIRSA-N 295.448 3.291 70 20 CGID CN(C(=O)c1cccc2c1CCC2)c1ccc2c(c1)OCO2 160276466 CYWWQSPIQGOMEW-UHFFFAOYSA-N 295.338 3.181 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(-c2cnco2)cc1 160281938 HMHMKMMVSFQOLM-SNVBAGLBSA-N 276.361 3.422 70 20 CGID CCCC1(CNC(=O)NCC2(CCOCC)CC2)CC1 160333227 YJOXOKSLAFWHMI-UHFFFAOYSA-N 282.428 3.073 70 20 CGID COCC[C@@H](C)NCCCC(=O)Nc1ccc(Cl)cc1 160808006 VEPVNCBRIBKOHL-GFCCVEGCSA-N 298.814 3.073 70 20 CGID CC[C@@H](C(=O)NC[C@]1(C)CCCO1)c1ccc(F)cc1 160946704 HUWFJOMCTKEQSK-ZBFHGGJFSA-N 279.355 3.005 70 20 CGID CC[C@H](NC[C@@H](C)N1CCc2ccccc2C1)C1CC1 159833474 IDAVENHFCABAKH-KDOFPFPSSA-N 272.436 3.211 70 20 CGID CCC(C)(CC)C(=O)N1CCO[C@@H](Cc2ccccc2)C1 159447704 OKLHCGQWDKEWBL-INIZCTEOSA-N 289.419 3.283 70 20 CGID CCCCO[C@H](C)C(=O)NCCc1cc2ccccc2[nH]1 159684582 NNEJKZXWKHTCOF-CYBMUJFWSA-N 288.391 3.032 70 20 CGID O=C(C[C@H]1C=CCCC1)Nc1ccc(S(=O)(=O)F)cc1 777784035 GEVHZQKPRCCBQM-NSHDSACASA-N 297.351 3.030 70 20 CGID C[C@H]1CCC[C@@H](CNCc2nn(C)c3ccccc23)C1 218135180 BMJNUCDHDYHWKO-UONOGXRCSA-N 271.408 3.489 70 20 CGID CN(CCOc1cccc(Cl)c1)C(=O)C1=CCCC1 160061348 XXRMYQDFMKISCW-UHFFFAOYSA-N 279.767 3.288 70 20 CGID CCOC(=O)CCCCN1CCC[C@@H]1c1cccc(C)n1 160064298 MSACRAGSMSXECY-MRXNPFEDSA-N 290.407 3.260 70 20 CGID Cc1ccc2cc(C(=O)NCCc3cccc(O)c3)[nH]c2c1 160205828 STSCZTSIPZUUQE-UHFFFAOYSA-N 294.354 3.154 70 20 CGID CCc1oc2ccccc2c1CN(C)CC(OC)OC 160349180 BFLVTXOEXPOQME-UHFFFAOYSA-N 277.364 3.046 70 20 CGID CCC(CC)(CC)NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 160537386 PQMFLJLHGFGWPX-UONOGXRCSA-N 282.428 3.212 70 20 CGID CCC[C@H](CCc1ccccc1)NC(=O)C[C@H]1CCCN1 160938978 IDAMUDZHLPROPH-IAGOWNOFSA-N 288.435 3.046 70 20 CGID C[C@H]1CC[C@H](C(=O)Nc2cc(CC3CCCCC3)n[nH]2)O1 159648300 NCVPIJKNWIIZMF-SMDDNHRTSA-N 291.395 3.039 70 20 CGID COc1ccc(Cl)c(N[C@H](C)CCn2cccn2)c1 159487714 VTYWUKNIYMZGPY-LLVKDONJSA-N 279.771 3.436 70 20 CGID C[C@@H](CNCc1ccc(Cl)cc1F)N1CCCCC1 160785096 WIZUEQKQRFBXHI-LBPRGKRZSA-N 284.806 3.443 70 20 CGID Cn1ncc2c1CCC[C@@H]2NCc1cccc2cc[nH]c12 218104883 WEADTBLHMSYGLR-HNNXBMFYSA-N 280.375 3.069 70 20 CGID C[C@H]1CC=CC[C@H]1COC(=O)c1ccc2c(c1)CCC(=O)N2 216788888 BKFDKSGKPIRPEP-WFASDCNBSA-N 299.370 3.330 70 20 CGID O=C(c1cc(Cl)ccn1)N1CCc2c(F)cccc2C1 160786319 BUVHWXHZOJKMLO-UHFFFAOYSA-N 290.725 3.073 70 20 CGID CCN(C)C(=O)c1ccccc1NC(=O)OC(C)(C)C 161166650 WQSJGKVICYXSSP-UHFFFAOYSA-N 278.352 3.126 70 20 CGID O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1Cc1cc(F)cc(F)c1 218730850 MLBGQFXLJJAMIE-OWCLPIDISA-N 281.346 3.090 70 20 CGID O=C(NCC1CCCCCC1)c1ccc2nc[nH]c2c1 217707717 GEZGUFKTRHGOEB-UHFFFAOYSA-N 271.364 3.263 70 20 CGID CCCC[C@@H](CC)CNC(=O)c1ccc(OC)cc1O 218084943 JVGZHENLPKFVFN-GFCCVEGCSA-N 279.380 3.347 70 20 CGID c1ccn2cc(CNCCCC3CCCC3)nc2c1 218212881 PEYLHAXEARDBOQ-UHFFFAOYSA-N 257.381 3.394 70 20 CGID O=c1[nH]c(N[C@H]2CCCc3sccc32)nc2ccccc12 161064570 AOFZKQVMOAARBO-LBPRGKRZSA-N 297.383 3.474 70 20 CGID CCOCCC1(CNC(=O)N2C[C@@H](C)CCC[C@H]2C)CC1 161509306 ZROSPHIUZXLLFH-LSDHHAIUSA-N 296.455 3.413 70 20 CGID C[C@H](Oc1ccccc1Cl)C(=O)NCC1(C2CC2)CC1 160066664 MDEOACMZCFYSHN-NSHDSACASA-N 293.794 3.414 70 20 CGID CC[C@@H](CC(=O)NCCN(C)C(C)C)c1ccc(C)cc1 160180242 GKBCTTKREHNKTJ-INIZCTEOSA-N 290.451 3.335 70 20 CGID Cc1ccn2c(CN(C)Cc3cccc(F)c3)cnc2c1 160462527 OQKLEFSGKBNAFS-UHFFFAOYSA-N 283.350 3.414 70 20 CGID CCCn1c(C)nnc1CN1C[C@@H](C)[C@@H]1c1ccccc1 160664743 CXNFHVFRTVKPOJ-CXAGYDPISA-N 284.407 3.190 70 20 CGID OCCCCCN(Cc1ccco1)Cc1ccco1 160957714 SBGRNNLROZQOLT-UHFFFAOYSA-N 263.337 3.037 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)NCCc1cscn1 159443974 NMYQCEBHCMWOJQ-JSGCOSHPSA-N 295.452 3.296 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@H]1c1cccc(F)c1F 159862296 YURAXBQQPYYTMP-STQMWFEESA-N 291.341 3.375 70 20 CGID CCc1cc(N[C@@H]2CCCc3cc(N)ccc32)nc(C)n1 159496054 NZQSDNJLAKOWFU-MRXNPFEDSA-N 282.391 3.419 70 20 CGID COc1cccc(CNCc2cccc3c2NCCC3)c1 159375586 HYCIPPNQRJJQOX-UHFFFAOYSA-N 282.387 3.343 70 20 CGID O=C(NCc1cccs1)Nc1cc(Cl)ccn1 217301472 FHMQBWZFVLQJQQ-UHFFFAOYSA-N 267.741 3.118 70 20 CGID Cc1ccc(CCNC(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 217225170 AQUHKKHLNNDQRN-GJZGRUSLSA-N 274.408 3.225 70 20 CGID CCC[C@@H](CCO)CNC(=O)C(C)(C)c1ccc(C)cc1 161184479 XZGFONFRDMXWNJ-HNNXBMFYSA-N 291.435 3.188 70 20 CGID CCC(CC)(CN)C(=O)N[C@H]1CCC[C@H](C(C)C)C1 161213674 ZGTPINZJQOUBGT-KBPBESRZSA-N 268.445 3.083 70 20 CGID Cc1nn(C)cc1CN[C@H](c1ccccc1)c1nccs1 161337667 OJYQDIKETCRJOC-OAHLLOKOSA-N 298.415 3.064 70 20 CGID CC[C@@H]1CCCC[C@H]1NCc1cccc(C(=O)NC)c1 161415694 TWWAXJLJVDUFDO-GDBMZVCRSA-N 274.408 3.105 70 20 CGID CCc1noc(C)c1CSCC(=O)c1cccn1C 160084149 NNKYVNALHUVRHG-UHFFFAOYSA-N 278.377 3.000 70 20 CGID C[C@@H](CC(=O)Nc1ccc2nccnc2c1)c1ccncc1 160114471 MYPABCVPMKKPGG-LBPRGKRZSA-N 292.342 3.157 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 160165001 QYRAHICTRDCAHN-WMLDXEAASA-N 286.375 3.188 70 20 CGID CC1(C)C[C@@H](NCc2c[nH]nc2-c2ccccc2)CCO1 160536824 UYLXLRPFAPMPKQ-HNNXBMFYSA-N 285.391 3.124 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ncnc2oc(C)c(C)c12 160547985 ZXOKNLJHXXAFDJ-BMIGLBTASA-N 273.336 3.214 70 20 CGID CCSc1ccccc1[C@H](C)NCC(C)(C)O 160610323 YABIAYASEDYSRJ-NSHDSACASA-N 253.411 3.220 70 20 CGID C[C@H](NCC(C)(C)O)c1cccc(-c2ccncc2)c1 160659574 MGBYASFHUQIWEJ-ZDUSSCGKSA-N 270.376 3.170 70 20 CGID Cc1cccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1C 160932038 RPRVHUVMQBXITO-HOCLYGCPSA-N 288.391 3.383 70 20 CGID CCOCCCCNC(=O)c1ccc(F)c(SC)c1 159414064 ORCGAEYTQNYRKD-UHFFFAOYSA-N 285.384 3.094 70 20 CGID Cc1nc(CC(=O)N2C[C@H](C)CCC[C@@H]2C)c(C)s1 159489961 QKMUFGRUWJECAQ-MNOVXSKESA-N 280.437 3.340 70 20 CGID C[C@@](O)(CN[C@@H]1CCc2ccccc21)c1ccsc1 159932190 GTBVZLJXFDFIKW-HZPDHXFCSA-N 273.401 3.233 70 20 CGID Cc1c(F)ccc2sc(NC(=O)[C@H]3OCC[C@H]3C)nc12 159542909 JQQGBPVHMVARHV-KRTXAFLBSA-N 294.351 3.107 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCCc2ccc(O)cc21 217768700 SZMICHLXOWWWPG-SUMWQHHRSA-N 276.424 3.090 70 20 CGID CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(C)nc1 161324523 QOXYYVIIANHRTK-GFCCVEGCSA-N 281.425 3.385 70 20 CGID CCOc1cccc(CNC(=O)Nc2ccc(C)nc2)c1 161506840 YQONWMSZORVNCC-UHFFFAOYSA-N 285.347 3.110 70 20 CGID C[C@H](C(=O)N(C)C1CC1)c1ccc(Br)cc1 160085484 PXCSBSQORIZADU-VIFPVBQESA-N 282.181 3.173 70 20 CGID CC[C@@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@@H](C)O1 160263179 KHBBTSZLQPXXHX-TZMCWYRMSA-N 267.413 3.229 70 20 CGID Cc1nc2c(c(N[C@@H]3CCO[C@H](C4CC4)C3)n1)CCCC2 160374826 YMIRJTOGIVDHGB-CJNGLKHVSA-N 287.407 3.033 70 20 CGID C[C@H]1CC[C@@H](CC(=O)Nc2ccnn2C(C)(C)C)C1 160581974 ZFQNSPMAVSXGOK-NWDGAFQWSA-N 263.385 3.403 70 20 CGID CC[C@@H](CC(=O)N[C@H](CO)CC(C)C)c1ccc(C)cc1 160854173 LDTPNFGSVSJJIW-RDJZCZTQSA-N 291.435 3.402 70 20 CGID Cc1cccc(C)c1NC(=O)CN(C)C[C@@H]1C[C@H]2C=C[C@H]1C2 160921537 NSXWJZSHTZFOQH-ULQDDVLXSA-N 298.430 3.386 70 20 CGID COC(C)(C)c1noc(-c2cc(C)c(F)c(C)c2)n1 160884031 XUCNQCQLKCSSJY-UHFFFAOYSA-N 264.300 3.374 70 20 CGID C[C@H](NCCOc1ccc(Cl)cc1)C1CCN(C)CC1 159650054 QQPJCOOLUGVMQU-ZDUSSCGKSA-N 296.842 3.039 70 20 CGID Cc1cccn2cc(CNC(=O)[C@H](C)c3ccsc3)nc12 159474958 TXXTWGBCOYPGQN-GFCCVEGCSA-N 299.399 3.124 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@@H](C)C(C)C)n1 159509056 NFFULAZBAQIZQM-LBPRGKRZSA-N 266.389 3.095 70 20 CGID CC[C@H](C)c1cc(C(=O)N(Cc2cccnc2)C2CC2)on1 159774672 UMZKWGQKZRGYOV-LBPRGKRZSA-N 299.374 3.388 70 20 CGID Cc1c([C@@H](C)NCc2cc(F)cc(Cl)c2)cnn1C 160890077 QZGQMBUECJDAKU-SECBINFHSA-N 281.762 3.372 70 20 CGID CCC(CC)CNC(=O)N1CCC[C@H]1c1ccc[nH]1 160592907 JKECBOLJEFGJCX-AWEZNQCLSA-N 263.385 3.297 70 20 CGID Cc1nc([C@H](C)N[C@H]2CCN3CCCC[C@@H]23)c(C)s1 217630036 DMJATZLQANXLHV-BPNCWPANSA-N 279.453 3.037 70 20 CGID O=S(=O)(Cl)c1ccc(CCl)cc1Cl 116620761 YITMCIZMGIVKNO-UHFFFAOYSA-N 259.541 3.006 70 20 CGID COCCC1(CNC(=O)N2CCC[C@H](C(C)C)CC2)CC1 161145268 KDBXFTOEDIKNLB-HNNXBMFYSA-N 296.455 3.271 70 20 CGID O=C(Nc1nccs1)N[C@@H]1CCCc2sccc21 161175798 OMKURJXFKOCLNE-SECBINFHSA-N 279.390 3.404 70 20 CGID CCO[C@H]1C[C@@H](N[C@@H](C)c2cnccn2)C1(CC)CC 161300691 OYONRWVISDMMML-CFVMTHIKSA-N 277.412 3.111 70 20 CGID CCO[C@H](C)c1nccn1CCN(C)c1ccccc1 161493590 MODRSFQFCUAKRK-CQSZACIVSA-N 273.380 3.117 70 20 CGID Cc1ccc(F)cc1C(=O)N[C@@H]1CCOC2(CCCC2)C1 160080194 BVNVRSUPTDNMBH-CQSZACIVSA-N 291.366 3.356 70 20 CGID COc1ccc(N(C)C(=O)c2ccoc2)cc1Cl 160115741 HKEDRNYOMBNEQA-UHFFFAOYSA-N 265.696 3.218 70 20 CGID CCC(=O)N1CCCC[C@H]1C(=O)N(CC)CC(CC)CC 160210143 UIYUGCUMTQJMIM-HNNXBMFYSA-N 296.455 3.062 70 20 CGID CC[C@@H](C)OCC(=O)N1CCC[C@H]1c1cccc(C)c1 160212285 DBCYDINVIXNZOK-ZBFHGGJFSA-N 275.392 3.474 70 20 CGID CCOC(=O)C(C)(C)N(C)C(=O)C1CCC(C)(C)CC1 160375949 FIBSJBXUEBZJDL-UHFFFAOYSA-N 283.412 3.003 70 20 CGID CCN(C(=O)Nc1ccc(O[C@H]2CCOC2)cc1)C(C)C 160436328 UYVHEOHWNGDKIS-HNNXBMFYSA-N 292.379 3.117 70 20 CGID C[C@H](NCc1nnc(-c2ccccc2)s1)c1cccnc1 160731001 DIHAHGFBAGDXRK-LBPRGKRZSA-N 296.399 3.451 70 20 CGID C[C@@H]1CN(Cc2noc(C3CCOCC3)n2)c2ccccc21 160792012 RWROQSQOCKDFBA-GFCCVEGCSA-N 299.374 3.087 70 20 CGID Cc1ccc(F)cc1NC(=O)N(C)[C@H]1CCSC1 159404062 JNHNTOBEPWXYFJ-NSHDSACASA-N 268.357 3.103 70 20 CGID Cc1cc(C)cc(CCN[C@@H]2C[C@H](C)N(C)C[C@@H]2C)c1 159475179 LJZGFVNQYYRWDB-XYJFISCASA-N 274.452 3.164 70 20 CGID CCCCn1ncc(C(=O)Nc2ncc(C)s2)c1C 159705944 HDAUQCDOWMAAKX-UHFFFAOYSA-N 278.381 3.009 70 20 CGID CCC[C@H]1CN(C(=O)Nc2ccnc(C)c2Cl)CCO1 159769246 QXOIKKDNKLJTSB-NSHDSACASA-N 297.786 3.076 70 20 CGID C[C@H](C[C@@H](O)c1ccco1)Nc1nc(C(C)(C)C)ns1 159961021 JGORHCXONLMJRC-NXEZZACHSA-N 295.408 3.353 70 20 CGID Fc1cc(Cl)cc(CNCc2ccc3c(c2)OCO3)c1 160814236 SVOSZRWGBMPSQB-UHFFFAOYSA-N 293.725 3.498 70 20 CGID FC(F)(F)c1cccc(CN[C@@H]2CCN3CCCC[C@@H]23)c1 217643934 IZDOPOAWVGNWJP-CABCVRRESA-N 298.352 3.422 70 20 CGID CC(C)C[C@@H](C)OCC(C)(C)CS(=O)(=O)Cl 114472728 XJTQYTNSBFDPCA-SNVBAGLBSA-N 270.822 3.032 70 20 CGID C[C@@H]1CCC[C@]1(C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 864238864 QTSXSDRHAHNZPG-YGRLFVJLSA-N 299.367 3.110 70 20 CGID C[C@@H]1CCO[C@@H]1C(=O)N[C@@H](c1cccc(F)c1)C(C)(C)C 161011452 UCECGZFWSFODPZ-UGFHNGPFSA-N 293.382 3.454 70 20 CGID CC(=O)NC1CCC(Nc2ccccc2OC(F)F)CC1 161126383 ZFTZSFHYOYNVAA-UHFFFAOYSA-N 298.333 3.147 70 20 CGID Cc1ccc(CN2CCN(c3ccccc3C)CC2)nc1 161417135 GHBIZHIMXZZZND-UHFFFAOYSA-N 281.403 3.021 70 20 CGID CCc1ccc(CNC(=O)N2CCC3(CCC3)C2)s1 160685501 DBTMQASCENVDIR-UHFFFAOYSA-N 278.421 3.396 70 20 CGID CC[C@H](c1ccc(F)cc1)N(C)Cc1nccn1C 160869872 QZHITTZGZVOHGW-CQSZACIVSA-N 261.344 3.142 70 20 CGID Cc1cccc(NC(=O)CN(C)OCc2ccccc2)c1C 159632102 KPYXIYQPQHEZQA-UHFFFAOYSA-N 298.386 3.306 70 20 CGID O=C(NCCCOc1ccccc1)N1CCC2(CCC2)C1 159451799 HVESVLCWOCUYIU-UHFFFAOYSA-N 288.391 3.041 70 20 CGID C[C@@H]1C[C@H]1c1ccc(CN(CCn2ccnc2)C2CC2)o1 159695514 VKZMAZBHIJVYDV-CZUORRHYSA-N 285.391 3.264 70 20 CGID COc1ccc(C(=O)N(C)Cc2ccsc2)c(F)c1 218629211 YIFMVTRUWLIKQI-UHFFFAOYSA-N 279.336 3.168 70 20 CGID O=C(CSc1ccc(F)cc1)N1[C@H]2C=CC[C@H]1CC2 218700247 XMQLMJFTBYPUQM-STQMWFEESA-N 277.364 3.237 70 20 CGID COc1ccc(OC)c(CCN[C@@H](C)c2ccco2)c1 161426396 XZZKJKKQGFVCJR-LBPRGKRZSA-N 275.348 3.190 70 20 CGID CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@@]1(C)CC 160025482 ICXRCLZMHCSJRZ-SUMWQHHRSA-N 289.375 3.200 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)Cc1cnn(-c2ccccc2)c1 160219172 HIQJYHJVYDXSFQ-FUHWJXTLSA-N 297.402 3.267 70 20 CGID O=C(Nc1cccc(OCCF)c1)c1cc(Cl)ccn1 160510985 AJKXUCCKPOJWOS-UHFFFAOYSA-N 294.713 3.336 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)N(CC(F)F)C(C)C 160511209 NYDQLAGFWJJHGK-VIFPVBQESA-N 288.338 3.287 70 20 CGID CCc1noc(C)c1CNc1cccc(F)c1F 159424051 ZQNANBOKSVPRJD-UHFFFAOYSA-N 252.264 3.436 70 20 CGID CN(Cc1nc2ccccc2n1C)C(=O)CCC(C)(C)C 159835247 NXWNGTAPAJAEDD-UHFFFAOYSA-N 287.407 3.358 70 20 CGID CCc1noc([C@@H](C)Nc2ccn(CCC(C)C)n2)n1 159894820 KYRADODTGHRFEC-LLVKDONJSA-N 277.372 3.048 70 20 CGID CC[C@H](C)[C@H](NCc1ccc(Cl)cc1F)C(=O)OC 160743155 XRGFSGGSZJGCEB-ZANVPECISA-N 287.762 3.156 70 20 CGID COC[C@@H](NC[C@@H](C)COCc1ccccc1)C(C)C 161307560 XKGANAGHGNJJOF-NVXWUHKLSA-N 279.424 3.100 70 20 CGID Cc1nc(CCN[C@H](C)c2nc(C(C)(C)C)no2)cs1 160270755 XLCWDCCZQYYSSQ-SECBINFHSA-N 294.424 3.025 70 20 CGID COc1ncccc1CN[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C 218475926 HFAUIQVRQYKQQM-JKIFEVAISA-N 274.408 3.395 70 20 CGID CO[C@H](C(=O)N1CCc2c(F)cccc2C1)c1ccccc1 161006122 QFTHOCPWEZNZML-KRWDZBQOSA-N 299.345 3.098 70 20 CGID COCCCCCSCCc1c(C)noc1C 160143345 QBVWCVVGPDFQEF-UHFFFAOYSA-N 257.399 3.384 70 20 CGID CC(C)=C[C@H]1[C@@H](C(=O)NCCc2cccc(O)c2)C1(C)C 160218062 QYOAVNWRFSCMPO-HOTGVXAUSA-N 287.403 3.289 70 20 CGID Cc1ccccc1NC(=O)Nc1ccn(CC(F)(F)F)n1 160346299 SSHKBZBKWJZEOE-UHFFFAOYSA-N 298.268 3.398 70 20 CGID CC(C)CCn1ccc(NC(=O)NC(C2CC2)C2CC2)n1 160639711 WCVWJIJTFHMMFS-UHFFFAOYSA-N 290.411 3.239 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c(C)c1 160665811 WIGAGWDVDPDSJW-CYBMUJFWSA-N 276.380 3.383 70 20 CGID Cc1cc(NC(=O)c2ccc(NC(C)C)nc2)ccc1O 160670559 INWMHQVTBPICRF-UHFFFAOYSA-N 285.347 3.168 70 20 CGID Cn1ccnc1CN1CCC[C@@H]1c1cccc(Cl)c1 160810677 JZKNQQMHCYLPFK-CQSZACIVSA-N 275.783 3.411 70 20 CGID COc1ccc(C[C@@H](C)C(=O)Nc2cccc(F)n2)cc1 160822816 MWBUYCCEHYEIIN-LLVKDONJSA-N 288.322 3.047 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(OC)cc1C 159588885 OMHPYQBLVNJJEY-WFASDCNBSA-N 261.365 3.312 70 20 CGID CC[C@@H](NCC1(CO)CCCC1)c1ccccc1OC 160072593 FDDKCEXCWAXVGS-OAHLLOKOSA-N 277.408 3.289 70 20 CGID CC(C)[C@@H]1CCCC[C@@H]1NC1CCC2(CC1)OCCO2 160341097 HBERXSCEGNGAET-HOTGVXAUSA-N 281.440 3.477 70 20 CGID CNC(=O)c1ccc(NCc2ccc(Cl)cc2F)cc1 160701892 PJQOLZCBIHWUCD-UHFFFAOYSA-N 292.741 3.451 70 20 CGID C[C@H](Cc1ccccc1F)NC1CCC2(CC1)OCCO2 161343700 URGIDLPXHJBQPZ-CYBMUJFWSA-N 293.382 3.032 70 20 CGID CCCOc1ccc(NCc2nnc3n2CCCC3)cc1 217318911 MVBKZJWLIFOLOY-UHFFFAOYSA-N 286.379 3.015 70 20 CGID CC[C@H](C)OCC(=O)Nc1cc(OC)ccc1Cl 161353722 AQJDSFDNRYQAKD-VIFPVBQESA-N 271.744 3.102 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@@H]2CCC(=O)C[C@H]2C)c1 161459315 MFPHCQAZGMMCIF-IAQYHMDHSA-N 287.359 3.223 70 20 CGID CC[C@H](NC(=O)c1occc1C)c1c(C)noc1C 160001472 SDFXFCNYFCAVFG-NSHDSACASA-N 262.309 3.074 70 20 CGID Cc1ccc(C(N)=O)cc1NCc1cccc2[nH]ccc12 160049572 YFLYMDYZZAUTGC-UHFFFAOYSA-N 279.343 3.187 70 20 CGID CC[C@@H](C)N(C)CCNC1CCN(C2CCCCC2)CC1 160061507 IJSOHMBXLALANF-MRXNPFEDSA-N 295.515 3.103 70 20 CGID CCc1ccc(/C=C/C(=O)NC(C)(C)c2nccs2)o1 160080667 LIAJNFKNDPIRHV-BQYQJAHWSA-N 290.388 3.363 70 20 CGID C[C@H]1CN(C(=O)NC(C)(C)C)C[C@@H](c2ccsc2)O1 160186114 IJBPNEBROGIURX-JQWIXIFHSA-N 282.409 3.018 70 20 CGID O=C(COc1ccccc1)N[C@@H]1CCCc2sccc21 160275611 QELWNXSRYATRLS-CQSZACIVSA-N 287.384 3.321 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccccc1OCC1CC1 160481105 FRDLKCWZPMCHJS-UHFFFAOYSA-N 298.386 3.086 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCc2ccccc2C1 160552248 REEFMQBPSKQAEV-UHFFFAOYSA-N 297.402 3.443 70 20 CGID CC(C)C[C@H]1CCN(C(=O)C[C@H](C)c2ccncc2)C1 160949690 FRNLLAQOENMMKJ-LSDHHAIUSA-N 274.408 3.470 70 20 CGID CC(C)Oc1ccccc1CNC(=O)NC1(C)CCC1 159836641 DJBYGEXRQMBIGS-UHFFFAOYSA-N 276.380 3.216 70 20 CGID CC[C@H](C)OCC(=O)N(Cc1ccccc1OC)C1CC1 159530593 ZDPBCSOLQZDBQY-ZDUSSCGKSA-N 291.391 3.001 70 20 CGID Cc1ccoc1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 159369990 IJWXMYMCBNBCKJ-ZBFHGGJFSA-N 299.370 3.486 70 20 CGID CC[C@@H]1CCCC[C@H]1NCc1noc(C(C)(C)C)n1 161433818 LHUBTFIMHASTON-VXGBXAGGSA-N 265.401 3.426 70 20 CGID CCCCCCN[C@H](CN1CCOCC1)c1ccccc1 216771307 GUPDXDICMJMDCH-GOSISDBHSA-N 290.451 3.230 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NCc1cccc(C(N)=O)c1)C2 218076817 MNSPSPKQZXUNHQ-MPGHIAIKSA-N 286.419 3.090 70 20 CGID CC/C(C)=C(/C)C(=O)Nc1cccc(S(=O)(=O)F)c1 460094623 RSLIWBUFJSGVQN-KTKRTIGZSA-N 285.340 3.030 70 20 CGID CCC1(CNc2ccc(C(=O)OC)c(C)n2)CCC1 218060913 ZJIBRPPSDUQKTO-UHFFFAOYSA-N 262.353 3.169 70 20 CGID CCc1ccc(/C=C/C(=O)N2CC[C@@H](OCC(C)C)C2)o1 161082610 KMTARRBZYGLJIP-KXPUMZMLSA-N 291.391 3.129 70 20 CGID CC(C)(C(=O)N[C@@H]1CCC[C@H](N)C1)c1ccccc1Cl 161284836 PGKFSHMIVCRKJR-NWDGAFQWSA-N 294.826 3.004 70 20 CGID CN(C[C@@H]1CCOC1)C(=O)C[C@@H]1CCCCC1(C)C 161395655 JYYFIFZYSPOXPH-KBPBESRZSA-N 267.413 3.088 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1nc(-c2ccccc2)ns1 161429715 GNDKHOIQBZTNAJ-LBPRGKRZSA-N 291.420 3.414 70 20 CGID Brc1ccc(N[C@@H]2CCO[C@@H](C3CC3)C2)nc1 160468964 YPGQFJURZVQSCN-VXGBXAGGSA-N 297.196 3.214 70 20 CGID CC[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccc(Cl)cc1 160502638 MBMZUIFERIJSKD-KGLIPLIRSA-N 281.783 3.476 70 20 CGID CC(C)(C(=O)Nc1ccccc1O)c1ccc(F)cc1 160530891 UFUPFHJKFSFJBI-UHFFFAOYSA-N 273.307 3.448 70 20 CGID CN(C)Cc1ccc(C(=O)N(C)CCc2ccccc2)cc1 159845805 QNGVQYBPNIGTTF-UHFFFAOYSA-N 296.414 3.063 70 20 CGID CCCC[C@@H](N[C@H](C)c1cccc(F)c1F)C(=O)OC 159489593 FULVVYGJBCOYSX-ZWNOBZJWSA-N 285.334 3.347 70 20 CGID CCN(C)C(=O)Nc1cccc(N2CCC(C)CC2)c1 159693136 KTWSSAXLPZBGNX-UHFFFAOYSA-N 275.396 3.407 70 20 CGID C[C@@H](N[C@@H]1CCOC(C)(C)C1)c1nc2ccccc2n1C 159934937 GRMKFTXSBIVWQK-CHWSQXEVSA-N 287.407 3.182 70 20 CGID Cc1cc(C)c(C)c(OC(=O)Cc2cn3ccccc3n2)c1 218510355 RXTIKAAHAANYGM-UHFFFAOYSA-N 294.354 3.408 70 20 CGID Cc1cccc(C)c1OCCCNC(=O)NC(C)(C)C 217298098 CNYULFJVXOAQTF-UHFFFAOYSA-N 278.396 3.170 70 20 CGID C[C@H]1CCC[C@@H](NC(=O)c2ccnc(Cl)c2F)C1 161412982 DGMUWDMKRPYYHD-DTWKUNHWSA-N 270.735 3.183 70 20 CGID COc1ccc(NC(=O)[C@H]2C[C@H]2C2CCCCC2)cc1N 161030432 MPGDBPUBBORLGY-KBPBESRZSA-N 288.391 3.432 70 20 CGID COc1ccc(C(F)(F)C(=O)NCC2(C3CC3)CC2)cc1 161478418 ISYFLEKFKFFCSM-UHFFFAOYSA-N 295.329 3.093 70 20 CGID CC[C@H](C)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 160497997 NGXFMCXJSYTORX-ZDUSSCGKSA-N 268.445 3.001 70 20 CGID CC(C)CSCCCNC(=O)C[C@@H](C)c1ccncc1 160690457 UXWRNGKJOQSWAW-CQSZACIVSA-N 294.464 3.471 70 20 CGID CCc1noc(C)c1CNc1cc(OC)c(OC)cc1F 159447835 OARVUXYIBUTVPP-UHFFFAOYSA-N 294.326 3.314 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)NC1CCCC1 159990733 GOEZAHWMNYKQIP-LLVKDONJSA-N 296.436 3.226 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(OC)cc1F 159616531 UMDYFKFKSLPBBS-HZMBPMFUSA-N 265.328 3.143 70 20 CGID CC(C)[C@@H]1CCCC[C@H]1NC1CCC2(CC1)OCCO2 160341332 HBERXSCEGNGAET-JKSUJKDBSA-N 281.440 3.477 70 20 CGID COCCN(Cc1ccccc1)Cc1ccsc1 160453859 BSCAPMDTVBJJSL-UHFFFAOYSA-N 261.390 3.397 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1 161111967 QXLNAJPHKDMFMR-WQVCFCJDSA-N 264.388 3.349 70 20 CGID Cc1cccc(CCNC(=O)N2C[C@@H](C)C[C@@H](C)C2)c1 217404437 GAQADWVMOJHLPS-GASCZTMLSA-N 274.408 3.225 70 20 CGID C[C@H](CNc1nc(Cl)nc2ccccc12)N(C)C1CC1 218723885 KCFCFYVQQNMVDY-SNVBAGLBSA-N 290.798 3.178 70 20 CGID CCc1ccccc1NC(=O)N[C@@H]1CCOC(C)(C)C1 161036407 NOFDUBPEZVXTPS-CYBMUJFWSA-N 276.380 3.328 70 20 CGID CCCCc1ccc(CC(=O)NOCc2cccnc2)cc1 160750860 PKGTVASZJKXCAG-UHFFFAOYSA-N 298.386 3.215 70 20 CGID COc1ccc2c(c1)[C@@H](N[C@H]1CCCSC1)CCCO2 159531530 VGDPNMCNYTXHBR-WFASDCNBSA-N 293.432 3.394 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(NC(C)=O)ccc1OC 159370296 ANCVNWTULMOVLA-LRDDRELGSA-N 290.363 3.028 70 20 CGID O=C(C=C1CCCCC1)Nc1ccc(S(=O)(=O)F)cc1 776364745 XFWADIHYPXAQKJ-UHFFFAOYSA-N 297.351 3.174 70 20 CGID COc1ccc(CN(C)CCOCC2CC2)cc1Cl 161015427 HWUBOASUVJNRIX-UHFFFAOYSA-N 283.799 3.207 70 20 CGID CCCN(CCO)Cc1ccc(F)cc1C(F)(F)F 161236743 DHKWBAQTSKIZNN-UHFFFAOYSA-N 279.277 3.049 70 20 CGID CC[C@H](NCCCOc1c(C)cccc1C)[C@H]1CCOC1 161237360 XWXNVRIGADZVLK-IRXDYDNUSA-N 291.435 3.477 70 20 CGID CC[C@H](NC(=O)Cc1ccc(F)cc1)c1c(C)noc1C 160232177 RILGBIPQYSUOEO-AWEZNQCLSA-N 290.338 3.241 70 20 CGID CC1(C)CCCN(C(=O)N[C@H]2CCO[C@H](C3CC3)C2)CC1 160301883 SFAAEFFJIJQRMS-GJZGRUSLSA-N 294.439 3.166 70 20 CGID CC[C@H](NC(=O)c1sccc1OC)c1c(C)noc1C 160359826 YASCJOSAHWISJX-JTQLQIEISA-N 294.376 3.243 70 20 CGID OCc1cc2ccccc2nc1N[C@H]1CCO[C@@H](C2CC2)C1 160442504 WGAKYQGYJIOCOY-DOTOQJQBSA-N 298.386 3.097 70 20 CGID CCC(C)(C)NC(=O)[C@@H]1C[C@@H]1c1sccc1C 160573151 IXRCQXPXASKRMR-WDEREUQCSA-N 251.395 3.465 70 20 CGID C[C@H](CNC(=O)CC[C@@H](C)c1ccccc1)C[C@@H](C)O 160685212 NQILZUHXTMPYLC-RRFJBIMHSA-N 277.408 3.094 70 20 CGID C[C@H](CCSc1ccccc1)N(C)C[C@H](O)C1CC1 160808255 HQTOBUBYWSMVDZ-CJNGLKHVSA-N 279.449 3.260 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@H](C)c1ccc2ccccc2c1 160935515 CODPHMXGVYUMOC-KDOFPFPSSA-N 299.414 3.467 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)c1ccc(OC)c(F)c1 159669065 SFZZIUUVAJEFLF-ABAIWWIYSA-N 265.328 3.233 70 20 CGID Cc1nc(CC(=O)N2CCC[C@@H]2C2CCCC2)c(C)s1 159531926 TZIGGSLFZYIKMH-OAHLLOKOSA-N 292.448 3.484 70 20 CGID Cc1ccc(Br)cc1C(=O)NC1(C)CCC1 159943261 ABCKWTTVAZKSKI-UHFFFAOYSA-N 282.181 3.430 70 20 CGID COc1cccc(Cl)c1CN[C@H]1CCOC(C)(C)C1 159778687 GNPQELNBHNZHDZ-NSHDSACASA-N 283.799 3.396 70 20 CGID C[C@@H](NC(=O)c1ccc2ccccc2c1O)C1CCC1 160224287 YYPSMEUJVIHQEU-LLVKDONJSA-N 269.344 3.464 70 20 CGID COc1ccc(CNCc2ccc(Cl)cc2F)cn1 160669604 DMFOHTLBPSFLGV-UHFFFAOYSA-N 280.730 3.173 70 20 CGID COc1ccc(/C=C/C(=O)N2[C@H]3C=CC[C@H]2CC3)cc1OC 218730654 MERCDMLCNZTMFX-LBXBEFBNSA-N 299.370 3.037 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCCCOc1ccccc1 217299720 QATBIUBRNOIWEO-OAHLLOKOSA-N 290.407 3.430 70 20 CGID CC[C@@H](c1ccc(F)cc1)N(C)Cc1nccn1C 160869733 QZHITTZGZVOHGW-AWEZNQCLSA-N 261.344 3.142 70 20 CGID CC[C@@H]1C[C@@H](C(=O)N[C@@H]2CCCc3sccc32)CCO1 160012842 IAVVYPOCLGWQCA-OUCADQQQSA-N 293.432 3.447 70 20 CGID C[C@H]1C[C@@H](C)CN(C(=O)COc2ccc3[nH]ccc3c2)C1 160074110 VBLMJMTXVJGAQC-BETUJISGSA-N 286.375 3.051 70 20 CGID Cc1cccc([C@H](C)NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c1C 160096924 UCMQGLQLPJPZSC-DUVNUKRYSA-N 287.403 3.486 70 20 CGID CC[C@H](C)C(=O)N(C)c1ccc(OC)c(Cl)c1 160254121 QEJXOGYJHKTSGR-VIFPVBQESA-N 255.745 3.358 70 20 CGID CC[C@@H](NC(=O)CCc1ccoc1)c1c(C)noc1C 160519765 MELAQQKVYZZZRR-CYBMUJFWSA-N 276.336 3.085 70 20 CGID CC[C@H](C)[C@H](C)NC(=O)Nc1cc(C(=O)OC)cs1 160676121 RIPBOROMRASKEK-IUCAKERBSA-N 284.381 3.091 70 20 CGID Cc1cccc(C)c1OCCn1cnc(C(C)C)cc1=O 160862093 ODGIIBZJWJCTCP-UHFFFAOYSA-N 286.375 3.063 70 20 CGID CCc1ccccc1NC(=O)CN(C)OCc1ccccc1 159634629 VZOCGWZETPXZFM-UHFFFAOYSA-N 298.386 3.251 70 20 CGID CCCC1(CNC(=O)NCc2csc(C)n2)CCC1 159579429 XUSBIODSVSTJFZ-UHFFFAOYSA-N 281.425 3.221 70 20 CGID O=C(NC(c1ccccc1)c1ccccc1)[C@H]1CCCCO1 159584462 PCINHXQFSSJOHD-QGZVFWFLSA-N 295.382 3.461 70 20 CGID CN(C)[C@@H](CNCc1cc(F)cc(F)c1)c1cccs1 159593013 KPNUYFINRUUDRK-AWEZNQCLSA-N 296.386 3.419 70 20 CGID CC1(C)C[C@@H](NC2CC(c3ccccc3)C2)CCO1 159972067 NFYXNYUAAQLJJU-PCKAHOCUSA-N 259.393 3.480 70 20 CGID Cc1nccn1CCCN1CC[C@@H](c2ccccc2)C1 159783187 BSMVIEBNYCTMIF-QGZVFWFLSA-N 269.392 3.071 70 20 CGID c1ccc2c(c1)C[C@H](CNCc1cccc3cc[nH]c13)O2 218089699 JKSAADIVVMCOBJ-MRXNPFEDSA-N 278.355 3.261 70 20 CGID O=S(=O)(Cl)c1ccc2c(c1)-c1ccccc1C2 100546184 VHMSGXZWBUZCLC-UHFFFAOYSA-N 264.733 3.185 70 20 CGID COc1ccc(NC(=O)C2(c3ccccc3C)CC2)cc1N 161035712 IPPUDVJRJJMOKU-UHFFFAOYSA-N 296.370 3.256 70 20 CGID C[C@H](C(=O)N(C)Cc1cccnc1)c1c(F)cccc1F 161061329 IGEBLINQTMIYHI-NSHDSACASA-N 290.313 3.122 70 20 CGID CC[C@H](SC)C(=O)O[C@H](c1ccccn1)C(F)(F)F 160106369 SWNFVGRHKXGHAM-VHSXEESVSA-N 293.310 3.370 70 20 CGID C[C@H](N[C@H](C)c1ccc([S@](C)=O)cc1)c1ccco1 160204220 QBXAIQXRPLQNGP-UYSIFFEZSA-N 277.389 3.429 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)NC[C@@H](C)c1c(C)noc1C 160231691 HKLGIRBYPDSSTJ-LERXQTSPSA-N 293.411 3.273 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(C2CC2)nc(C)n1 160275309 PFKKXVWAJHWUJH-NHYWBVRUSA-N 259.353 3.037 70 20 CGID Cc1cc(N[C@@H]2CCO[C@H](c3ccccc3)C2)ncn1 160531668 JGJSDDAMKOCRGS-CABCVRRESA-N 269.348 3.117 70 20 CGID CCC(CC)c1cc(C(=O)Nc2c(C)n[nH]c2C)on1 160792304 JTMUJZJENSWYEN-UHFFFAOYSA-N 276.340 3.170 70 20 CGID CCc1ccc([C@H](CO)Nc2ccnc(C(C)C)n2)cc1 160908687 SQNUOECSFHEBKM-HNNXBMFYSA-N 285.391 3.308 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)c1cccc(OC)c1 159681631 XBVXCKWRNDZLOK-ZENOOKHLSA-N 275.392 3.494 70 20 CGID CCOc1ccc([C@@H](C)N[C@@H](COC)C2CC2)cc1OC 159978648 CFSKSFKGYVVIQV-DOMZBBRYSA-N 293.407 3.170 70 20 CGID CCN(C(=O)CCC(=O)c1ccc2c(c1)CCC2)C1CC1 159595348 HIARMQSFKPBVMJ-UHFFFAOYSA-N 285.387 3.149 70 20 CGID C[C@@H](NCc1ccc(F)c(C(F)(F)F)c1)[C@@H]1CCOC1 160153602 KWMKWXOBHNWMSB-MWLCHTKSSA-N 291.288 3.359 70 20 CGID C[C@H]1CCC[C@H](CNCc2nn(C)c3ccccc23)C1 218135341 BMJNUCDHDYHWKO-KBPBESRZSA-N 271.408 3.489 70 20 CGID CC[C@@H](C(=O)Nc1ccc2[nH]nnc2c1)c1ccc(F)cc1 161102898 LRDHMHXBAQMECM-CYBMUJFWSA-N 298.321 3.229 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1ccnc2ccccc12 161418299 SRZUWLAAOMEDMH-VXGBXAGGSA-N 254.333 3.248 70 20 CGID CC[C@@H](Cc1ccccc1)N(CC)C(=O)CC1(N)CCC1 161437286 GOLAQWFSGGAMGQ-INIZCTEOSA-N 288.435 3.128 70 20 CGID CCc1c(-c2nc(C(C)(C)C)no2)cnn1CC(C)C 161441747 TVMNAGDTQKUDSB-UHFFFAOYSA-N 276.384 3.449 70 20 CGID Cc1[nH]ccc1C(=O)N[C@H]1CCCc2sccc21 160006633 JBUDHIRPGFGPPE-LBPRGKRZSA-N 260.362 3.192 70 20 CGID CCC(CC)(CC)CNC(=O)NCC(C)(C)C[C@@H](C)O 160036672 YOPWMXVTDYXOHS-CYBMUJFWSA-N 286.460 3.299 70 20 CGID C[C@@H](C(=O)N(CCN(C)C)C1CCCC1)c1cccs1 160059541 AIZHMBZFYQPTIH-CYBMUJFWSA-N 294.464 3.184 70 20 CGID COc1ccc(N(C)C(=O)[C@@H]2C[C@H]2C2CC2)cc1Cl 160311667 BYPWOMIZQJBPMD-NWDGAFQWSA-N 279.767 3.358 70 20 CGID Cc1nc2ccccn2c1CN1CCS[C@H](C(C)C)C1 160878591 QMSXHZACWIOBED-HNNXBMFYSA-N 289.448 3.216 70 20 CGID CC[C@H](C)OCC(=O)NCc1cccc(OCC(C)C)c1 160986217 GQWCQLJMPKBMBT-AWEZNQCLSA-N 293.407 3.153 70 20 CGID CCSCC[C@@H](C)NC[C@H](O)c1ccc(F)cc1F 160170536 HVWJAMWFELQGRO-YGRLFVJLSA-N 289.391 3.120 70 20 CGID C[C@H]1CCCC[C@H]1CNC[C@@H](O)c1ccc(F)cc1 218434358 MNVRQPGDIMTAMM-DUVNUKRYSA-N 265.372 3.275 70 20 CGID CCN(CCCCCO)Cc1ccc(Cl)s1 160961042 UVNNDTJOMHQLGB-UHFFFAOYSA-N 261.818 3.386 70 20 CGID CCc1nc2c(s1)[C@H](N(C)C(=O)c1cc[nH]c1)CCC2 161007791 XPWIAMSWUVEZHK-GFCCVEGCSA-N 289.404 3.183 70 20 CGID CCCCSCCC(=O)Nc1ccc(OC)c(N)c1 161398430 PRRKRUADQNFNLH-UHFFFAOYSA-N 282.409 3.139 70 20 CGID CCO[C@H](C)c1nccn1Cc1ccc(F)c(F)c1 161453458 UPWSMZGUIKMNAL-SNVBAGLBSA-N 266.291 3.307 70 20 CGID CCC[C@H](N)C(=O)NC1(c2ccccc2)CCCCC1 160049715 PDRYKESGCFRLGP-HNNXBMFYSA-N 274.408 3.090 70 20 CGID CCc1cc(NC(=O)[C@@H](CC)c2ccc(F)cc2)n(C)n1 160074508 HRZUHPZPNKKOQA-AWEZNQCLSA-N 289.354 3.254 70 20 CGID CCCCNC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 160184911 OGBWAGXSMUUDJY-AAEUAGOBSA-N 282.409 3.020 70 20 CGID CCc1nsc(NC[C@@](C)(O)c2ccccc2Cl)n1 160202290 YTOIQHBLYKIART-CYBMUJFWSA-N 297.811 3.074 70 20 CGID CS[C@@H](C)CC(=O)Nc1cccc(-c2cnco2)c1 160468734 UFWUMAKAKZDAHE-JTQLQIEISA-N 276.361 3.422 70 20 CGID COc1cc(CNC(=O)N2CC[C@@H](C)[C@@H](C)C2)ccc1C 160862697 NHGDSIIBELVBJO-OCCSQVGLSA-N 290.407 3.191 70 20 CGID CCCC[C@@H](CCC)NC(=O)c1cccc2[nH]c(=O)oc12 160940208 YRBFUGLRZRDCKD-LLVKDONJSA-N 290.363 3.210 70 20 CGID CC(C)(C)c1nsc(NC[C@@](C)(O)c2ccccc2)n1 159486796 TWPZBVJELXRBBY-OAHLLOKOSA-N 291.420 3.155 70 20 CGID Cc1cc(C(=O)NCC2(C3CC3)CC2)c(F)cc1F 159708947 TYXWXRCVUQOWCD-UHFFFAOYSA-N 265.303 3.193 70 20 CGID Cc1cc(Cl)ccc1OC(=O)[C@H]1CCCCO1 159585029 BITAPLFACPPLSH-GFCCVEGCSA-N 254.713 3.123 70 20 CGID COc1ccc(C)cc1[C@@H](C)NCC1(CO)CCCC1 160068294 PXLVOOQLMWDPNZ-CQSZACIVSA-N 277.408 3.207 70 20 CGID CCS[C@@H]1CCC[C@@H]1Nc1ncnc(CC)c1F 218056815 HTAKGPFUAMBXDF-WDEREUQCSA-N 269.389 3.264 70 20 CGID CC[C@H]1CCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239062 UULCNNAGSCGARF-GXFFZTMASA-N 299.367 3.110 70 20 CGID CCC[C@@H](C(=O)N[C@@H](C)c1cc2ccccc2o1)N(C)C 161279299 LFKKIQLLMQCBNK-JSGCOSHPSA-N 288.391 3.340 70 20 CGID CCC[C@@H](C)[C@@H]1CCCN1Cc1nnc(C)n1CCC 161428898 QYGBAEWPPQIIHA-HIFRSBDPSA-N 278.444 3.397 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cccc(Oc2cnccn2)c1 161509042 SLQXCNLIFDHDRY-STQMWFEESA-N 297.358 3.282 70 20 CGID CC1(C)C[C@H]1C(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 160600798 CBHXVERXXHJZJQ-HOTGVXAUSA-N 287.403 3.240 70 20 CGID CCOc1ccccc1NC(=O)N[C@@H]1CCOC(C)(C)C1 160909961 AOVMJLOFYYNRHA-GFCCVEGCSA-N 292.379 3.164 70 20 CGID CC(C)CCC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 159813760 SSOKRJDISVIERM-ZBFHGGJFSA-N 277.408 3.094 70 20 CGID Cc1ccc(OCc2noc(C3CCCCC3)n2)nc1 159828387 DMQYUUSBYXVCES-UHFFFAOYSA-N 273.336 3.400 70 20 CGID CCCC[C@H](CCC)NC(=O)N1CCCN(CC)CC1 159947749 FIIUCRQFLVGGAG-HNNXBMFYSA-N 283.460 3.083 70 20 CGID C[C@@H](NC(=O)c1cccc2[nH]cnc12)[C@H](C)c1ccccc1 159787619 DLLYDDFWZBCIIM-QWHCGFSZSA-N 293.370 3.485 70 20 CGID CN(CCSc1ccc(F)cc1)C[C@H]1CCC[C@@H]1O 159747068 BQMCOUGTMOBRSY-DOMZBBRYSA-N 283.412 3.011 70 20 CGID Cc1ccc(S(=O)(=O)N2CC[C@@H](C(C)(C)C)C2)cc1 218735851 SOZZBBQPMQGGNO-CYBMUJFWSA-N 281.421 3.052 70 20 CGID Cc1cc(C)c(S(=O)(=O)N2[C@H]3C=CC[C@H]2CC3)c(C)c1 218758248 BIPKSBQRJHWISM-GJZGRUSLSA-N 291.416 3.093 70 20 CGID O=C(N[C@@H](c1ccccc1)C1CC1)c1ccccc1O 217565699 KLGIXTXVBKORCT-INIZCTEOSA-N 267.328 3.273 70 20 CGID CC(C)CN[C@@H](CNC(=O)OC(C)(C)C)CC(C)C 218100699 OJCQWXCCVGXTOL-CYBMUJFWSA-N 272.433 3.171 70 20 CGID C[C@H](NC(=O)Nc1ccn(Cc2ccccc2)n1)C1CCC1 161395955 YQPDMCUVAQSXKP-ZDUSSCGKSA-N 298.390 3.242 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160331222 AOKQTGMVPDEYIF-LSDHHAIUSA-N 297.439 3.190 70 20 CGID C/C=C(\C=C\C(=O)Nc1ccc(C(=O)N(C)C)cc1)CC 160371918 MFAPRMICXGIHAQ-CMKIIFMYSA-N 286.375 3.239 70 20 CGID CC1(C)C[C@@H](Nc2ncnc3cc(F)c(F)cc23)CCO1 160676479 QJSMIAJHJWCRPV-VIFPVBQESA-N 293.317 3.278 70 20 CGID CC[C@H](C(=O)N[C@@H]1CCCSC1)c1ccc(F)cc1 160774210 VZZXJBLAYOTHTD-KGLIPLIRSA-N 281.396 3.331 70 20 CGID Fc1cc(-c2nc([C@H]3CCOC3)no2)c(F)cc1Cl 160888449 RZXVZTVPKSIDDV-LURJTMIESA-N 286.665 3.172 70 20 CGID CCc1nnc(COc2ccc(OC(F)(F)F)cc2)o1 160917538 GMCWLGBPHJXNGW-UHFFFAOYSA-N 288.225 3.110 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1c1nc(-c2ccsc2)no1 160993020 WZMSIAXSNAFNGK-LDYMZIIASA-N 262.334 3.271 70 20 CGID O=C(c1cc(F)cc(Cl)c1O)N1C[C@@H]2CCC[C@H]2C1 159422595 CJWONRMOUHAVAL-IUCAKERBSA-N 283.730 3.057 70 20 CGID Cc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCCSC1 159534835 FTBGFDKLEPDRFT-ZIAGYGMSSA-N 292.448 3.197 70 20 CGID COc1ccccc1CNC(=O)c1ccc(C(C)C)nc1 159581029 SOEJNGFWHPJKMX-UHFFFAOYSA-N 284.359 3.144 70 20 CGID COC(=O)c1ccnc(NC[C@H]2CCC[C@@H](C)C2)c1 217929247 UVYJNYUUWBAEKH-NEPJUHHUSA-N 262.353 3.106 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@H]1CCOC(C)(C)C1 161051829 AAFHVULFHJEJGS-LBPRGKRZSA-N 280.343 3.213 70 20 CGID CS[C@@H](C)CC(=O)Nc1cc(Cl)ccc1N(C)C 161247204 CIAILMHHFAPNON-VIFPVBQESA-N 286.828 3.486 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCc3ccccc32)cn1 161398345 MTGRUTZEJKMDKL-OAHLLOKOSA-N 267.332 3.199 70 20 CGID CCOc1cccc(CNC(=O)N2CCC3(CCC3)C2)c1 160082686 CXUVHBDWEMRFMF-UHFFFAOYSA-N 288.391 3.171 70 20 CGID CC(C)C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccccc1 160103406 NRNXHPAGFNOSEZ-HOTGVXAUSA-N 275.392 3.459 70 20 CGID COc1cc(CNC(=O)C[C@@H](C)c2ccncc2)ccc1C 160204129 MJLVUOVYSMJOSQ-CQSZACIVSA-N 298.386 3.209 70 20 CGID CCCCO[C@H](C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160331375 AOKQTGMVPDEYIF-HUUCEWRRSA-N 297.439 3.190 70 20 CGID CCc1ccccc1C(=O)N[C@@H](C)c1cccnc1 160671346 LBWXNISAPMYXRP-LBPRGKRZSA-N 254.333 3.135 70 20 CGID C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1nncn1C 160759064 YRIPUTMONBWVEB-VIFPVBQESA-N 299.205 3.315 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCC[C@H](N)C1)c1ccc(F)cc1Cl 159626694 JGFRENDNLQTPKK-FOGDFJRCSA-N 298.789 3.174 70 20 CGID CCCCn1ncc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)c1C 159921155 IESGLLGLXPJSSI-KBPBESRZSA-N 290.411 3.255 70 20 CGID COc1ccc(N(C)C(=O)c2cscc2C)cc1F 159582355 PESPQJCXVYGDFB-UHFFFAOYSA-N 279.336 3.481 70 20 CGID c1sc(C2CC2)nc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 159589202 UFWMHSAFKUIBGK-MJBXVCDLSA-N 290.432 3.068 70 20 CGID Fc1cc(CN[C@H]2CCN3CCCC[C@@H]23)ccc1Cl 218314954 VJFGESGPVSAVPE-GJZGRUSLSA-N 282.790 3.196 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@H]1CCC(C)C 161427997 RHQKVMLWVZMQQW-HNNXBMFYSA-N 278.444 3.397 70 20 CGID CCc1noc([C@H](C)SCc2c(CC)noc2C)n1 160005089 ZNFNXMRDHOOSGQ-VIFPVBQESA-N 281.381 3.485 70 20 CGID C[C@H](C(=O)N(CCN(C)C)C1CCCC1)c1ccsc1 160059833 LKOKZKLELIXKED-ZDUSSCGKSA-N 294.464 3.184 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](C)[C@H](C)CC)c1 160566460 QRCVWGDZMUVWEN-ZIAGYGMSSA-N 276.424 3.351 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(-n2ccnc2)cc1 160816799 WMDSCLZERYISCR-ZBFHGGJFSA-N 269.348 3.247 70 20 CGID COC[C@@H](C)NCc1ccnc(O[C@H](C)CC(C)C)c1 160836630 XNXDBTRXWYSOFJ-ZIAGYGMSSA-N 280.412 3.020 70 20 CGID CC(C)CCC[C@H](C)NC(=O)NOCc1cccnc1 160983536 JXQBPCZKMWBEGP-ZDUSSCGKSA-N 279.384 3.027 70 20 CGID COC(C)(C)C[C@H](C)Nc1nc(C(C)(C)C)ns1 159659791 SREIRXOIUPSVGK-VIFPVBQESA-N 271.430 3.451 70 20 CGID CCOCCC1(CNC(=O)C[C@@H]2CC[C@@H](C)C2)CC1 159477353 PTKDCQGAJGMWTA-ZIAGYGMSSA-N 267.413 3.136 70 20 CGID Cc1ccccc1C(=O)N[C@@H]1CCCc2cc(N)ccc21 159364794 PVGBOMOZTODECM-QGZVFWFLSA-N 280.371 3.385 70 20 CGID Cc1ccc(C)c([C@H](C)N(C)C(=O)CC2CCNCC2)c1 159967300 BHRJGAHXTAPZKH-HNNXBMFYSA-N 288.435 3.213 70 20 CGID CCc1noc(C)c1CSCC(=O)N1CCCC[C@@H]1C 159982741 NJWBTGXKQHMRSC-NSHDSACASA-N 296.436 3.180 70 20 CGID CC[C@@H](C)N(C)CCNCc1csc(C(C)(C)C)n1 217394189 XQTGQFFQNWJHOD-GFCCVEGCSA-N 283.485 3.261 70 20 CGID CC[C@@H](NC(=O)c1ccc(Cl)c(F)c1)c1ncc[nH]1 218078152 LQUJIIZUVUYDCB-LLVKDONJSA-N 281.718 3.083 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)CC(C)C)n1 161264908 LFEQHZMHZMLARS-UHFFFAOYSA-N 272.352 3.019 70 20 CGID Cc1cccnc1[C@H](NC(=O)NC1(C)CCC1)C(C)C 161292161 HILHCISHECWNLG-CYBMUJFWSA-N 275.396 3.329 70 20 CGID CC1(C)CCC(C(=O)N2CCOC3(CCCC3)C2)CC1 161305058 UJHZHJJADUNPNN-UHFFFAOYSA-N 279.424 3.374 70 20 CGID COc1ccc(COCCC(=O)N2[C@H](C)CC[C@H]2C)cc1 161505941 HPEZWGAKSPLGKI-ZIAGYGMSSA-N 291.391 3.001 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)C1(CC(C)C)CCCC1 160085379 WDBWLIURDMBICP-CYBMUJFWSA-N 283.412 3.051 70 20 CGID FC(F)(F)C1=CCN(c2ccc(Cl)cn2)CC1 160254332 JWEGYIBLNKOHPL-UHFFFAOYSA-N 262.662 3.434 70 20 CGID C[C@@H](NC(=O)N1CCc2cccc(F)c2C1)C1CCC1 160277485 SGWCYYOJJHIFDI-LLVKDONJSA-N 276.355 3.082 70 20 CGID O=C(NCc1ccco1)c1ccccc1NCc1ccco1 160430436 LVQZQWPDMNOVJK-UHFFFAOYSA-N 296.326 3.415 70 20 CGID FC(F)(F)c1ccc(OCCN[C@@H]2CCSC2)cc1 160505545 KNFHFLGRBBMXBL-LLVKDONJSA-N 291.338 3.179 70 20 CGID CCC(CC)CC(=O)Nc1ccnn1C(C)(C)C 160580361 QPQQDCPAZYGRBV-UHFFFAOYSA-N 251.374 3.403 70 20 CGID C[C@@H](C(=O)NCCNC1CCCCCC1)c1cccs1 159659576 HPDBXXQDIIZWSL-CYBMUJFWSA-N 294.464 3.280 70 20 CGID CC(C)[C@H](O)CNC(=O)c1ccccc1Oc1ccccc1 159763632 PXBMLYPZZVLQCF-MRXNPFEDSA-N 299.370 3.226 70 20 CGID Clc1ccccc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 159615754 CLRZQCYUAZTCQO-CFVMTHIKSA-N 277.795 3.387 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1ccc(Br)cc1 161396965 ARYPYXYJOQTDMN-UWVGGRQHSA-N 282.181 3.462 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)c2occc2C)n1 161163119 LBHARHUBKROSDI-UHFFFAOYSA-N 296.330 3.188 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)NC[C@@H](C)CN2CCCCC2)C1 161212657 RPSIEGSTCSOSFN-BZUAXINKSA-N 280.456 3.051 70 20 CGID COc1ccc(NC(=O)C(C)=C2CCCC2)cc1N 161242994 CGELRGIAQATJSO-UHFFFAOYSA-N 260.337 3.106 70 20 CGID COC[C@@H](NC(=O)[C@H](C)Cc1cccc(Cl)c1)C1CC1 161284688 DGBJLQJNVGJAHS-IAQYHMDHSA-N 295.810 3.060 70 20 CGID CCCCNC(=O)c1ccc(CN[C@@H](C)CC)cc1 160113838 ZHLPAMQSVIGOMR-ZDUSSCGKSA-N 262.397 3.105 70 20 CGID FC(F)Oc1ccc(N[C@H]2CCO[C@H](C3CC3)C2)nc1 160274985 PFTRUODOCFKIAN-JQWIXIFHSA-N 284.306 3.053 70 20 CGID CCC(CC)CC(=O)Nc1nnc(-c2ccc(C)o2)[nH]1 160348204 NMRQLOFMAZKVKT-UHFFFAOYSA-N 276.340 3.138 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccc(Cl)s1 160674889 PCDUWODIKIOXFJ-UHFFFAOYSA-N 268.769 3.012 70 20 CGID CCN(C(=O)CCCc1sccc1C)C1CC1 160793890 BTDUSKOXGKOJTI-UHFFFAOYSA-N 251.395 3.390 70 20 CGID CC1CCC(C)(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)CC1 159659385 PNNPEVDITUMUJT-QJKCGZJTSA-N 294.439 3.212 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CCCC[C@H]1C 159463084 WDMCPRWEMFDYDZ-LLVKDONJSA-N 285.347 3.060 70 20 CGID Cc1nc2ccc(NC(=O)[C@H]3CCCCO3)cc2s1 159669517 YTJGMEAVUOAZEW-GFCCVEGCSA-N 276.361 3.112 70 20 CGID NCc1ccc(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2)cc1 159718939 VSWMBTYMIZHLRI-MSOLQXFVSA-N 294.398 3.211 70 20 CGID Cc1nccc(NC(=O)N(C)[C@@H]2CCSC2)c1Cl 159540915 SLIDAUSAMHXEIU-SECBINFHSA-N 285.800 3.013 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)CSCc1ccccn1 159759455 FQFJPKFFPXNULT-JSGCOSHPSA-N 278.421 3.010 70 20 CGID COc1cccc([C@H](C)NC[C@@H]2CCC(C)(C)O2)c1 160325234 JDAFLXKXSUYLKJ-WFASDCNBSA-N 263.381 3.303 70 20 CGID CC(C)NC(=O)CN[C@@H](C)c1cc(Cl)cc(Cl)c1 160992401 RMNCTURWGWHURA-VIFPVBQESA-N 289.206 3.169 70 20 CGID C[C@H]1CCCCN1CCC(=O)Nc1ccc2c(c1)CCC2 217665795 LMPHKVODNGAGTR-AWEZNQCLSA-N 286.419 3.378 70 20 CGID CCCn1nccc1CNc1cc(F)cc(F)c1 159970449 OOOXSYYZHROOCR-UHFFFAOYSA-N 251.280 3.183 70 20 CGID CC[C@H](C(=O)N[C@H](CC)[C@@H]1CCCO1)c1ccc(F)cc1 161395167 YGPFBRCMDNSKED-XHSDSOJGSA-N 293.382 3.393 70 20 CGID CC(C)C1CCC(NC(=O)N(C)CC2CCOCC2)CC1 160053488 MSLINYHXTWAFBW-UHFFFAOYSA-N 296.455 3.269 70 20 CGID CCc1nc2c(s1)[C@H](NCCN(C)[C@@H](C)CC)CCC2 160106648 LYIZSKMOBMHBLG-QWHCGFSZSA-N 295.496 3.403 70 20 CGID CC[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC[C@H]1N 160237734 SEBSZUSHLDAIHI-ZHCJQAHYSA-N 292.467 3.179 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H](COC)C2CC2)C1 159458676 ZGGNZTPAMCPIEG-RDBSUJKOSA-N 257.443 3.065 70 20 CGID CC(C)n1nccc1C(=O)N[C@H]1CCCc2sccc21 159852181 KPTUFYDPUBDGPA-LBPRGKRZSA-N 289.404 3.333 70 20 CGID CCCCn1ncc(C(=O)Nc2nc(C)cs2)c1C 159473558 XEKWVOBZTUKJOZ-UHFFFAOYSA-N 278.381 3.009 70 20 CGID C[C@H](NC[C@H](C)N1CCc2ccccc21)c1cncc(F)c1 159930878 VWKAXVVKHJLULF-KBPBESRZSA-N 299.393 3.323 70 20 CGID Cc1cc(NC(=O)C2(CC(C)C)CCCC2)c[nH]c1=O 159578438 XCERCCBWKLSNNL-UHFFFAOYSA-N 276.380 3.228 70 20 CGID C[C@@H](CCC(C)(C)C)NC(=O)C[C@@H](C)C1CCNCC1 159772930 IHVMRMSWJUHKTF-KGLIPLIRSA-N 282.472 3.343 70 20 CGID COc1cc(NC(=O)N[C@H](C)C2CCC2)cc(OC)c1 159395593 KGQGGDXQWRNWRN-SNVBAGLBSA-N 278.352 3.014 70 20 CGID Cc1cccc(C(=O)NCCOC2CCCCC2)c1F 161485955 VPHCIVJPGLAZKA-UHFFFAOYSA-N 279.355 3.213 70 20 CGID O=C(Nc1ccc(F)c(F)c1)N[C@@H]1CCO[C@@H](C2CC2)C1 161002659 KPVOFNKQPPVLBL-BXUZGUMPSA-N 296.317 3.044 70 20 CGID CCCCn1ncc(C(=O)N(C)[C@@H](C)c2ccco2)c1C 161132503 MNSHYSNITKKWEU-ZDUSSCGKSA-N 289.379 3.418 70 20 CGID CC[C@H](C)c1cc(C(=O)N2CCC[C@@H](CC)C2)on1 160324794 RKTPDEPKQXXKMX-NWDGAFQWSA-N 264.369 3.450 70 20 CGID CCc1ccc(C(=O)Nc2nnc(-c3ccc(C)o3)[nH]2)cc1 160434788 SAMOIQAJGIPICY-UHFFFAOYSA-N 296.330 3.188 70 20 CGID Cc1ccc(F)c(OCC(=O)N(C)c2ccccc2F)c1 160479253 CASFGWGUFKKONE-UHFFFAOYSA-N 291.297 3.315 70 20 CGID CC[C@@H]1CN(C(=O)CCCc2sccc2C)CCO1 160822616 RQDRCZORIVMPLU-CYBMUJFWSA-N 281.421 3.017 70 20 CGID CCOc1cccc(NC(=O)C[C@@H]2CSCCS2)c1 159685036 VERONVFZPACWJX-CYBMUJFWSA-N 297.445 3.263 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccccc1Cl 159930059 VMGKCGKNANCYPK-GWCFXTLKSA-N 267.756 3.086 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2cc(N)ccc2Cl)O1 160776970 QNNZBQLXQUMZTN-JTQLQIEISA-N 283.755 3.037 70 20 CGID O=S(=O)(Cl)CCc1cc2ccccc2s1 169724509 XCJPXMQCJDRTET-UHFFFAOYSA-N 260.767 3.012 70 20 CGID COc1ccc([C@H](C)NC(=O)NCC2CCCC2)cc1 217565694 OQJYPMQFKZKHEQ-LBPRGKRZSA-N 276.380 3.246 70 20 CGID C[C@@H](CNc1nc(Cl)nc2ccccc12)N(C)C1CC1 218723812 KCFCFYVQQNMVDY-JTQLQIEISA-N 290.798 3.178 70 20 CGID CC(C)C1CCN(C(=O)[C@H](C)[C@@H](N)c2ccccc2)CC1 161269170 FWMDAZDAAJMDJR-RHSMWYFYSA-N 288.435 3.217 70 20 CGID CC(C)CCn1ccc(NC(=O)N2C[C@@H](C)C[C@@H](C)C2)n1 161403962 CQTGFGMCINDKHK-OKILXGFUSA-N 292.427 3.439 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@H]1C[C@@H]2CC[C@@H]1O2 160196722 BBXRYIZEZFNEPL-DUPGQFARSA-N 290.359 3.175 70 20 CGID CC[C@@H]1CCCCN1CCNC(=O)[C@@H](C)c1cccs1 160247576 COHLDJHDYPBXJG-UONOGXRCSA-N 294.464 3.232 70 20 CGID CNC(=O)c1ccc(NC(=O)CC2CCCC2)c(Cl)c1 160307479 PYLBBUOYJMYYFB-UHFFFAOYSA-N 294.782 3.218 70 20 CGID CC[C@H](CN[C@@H](C)C1CCOCC1)Oc1ccccc1F 160341223 MKOUXRHNUAAZLC-DZGCQCFKSA-N 295.398 3.388 70 20 CGID COc1ccc(CCCN(C)C(=O)C[C@H](C)SC)cc1 160766670 HJPFLUBFUCQWNK-ZDUSSCGKSA-N 295.448 3.228 70 20 CGID CCCCOc1cccc(CN[C@H](C)c2cnn(C)c2)c1 160824078 HMWKDGHKWVPNGI-CQSZACIVSA-N 287.407 3.450 70 20 CGID C[C@@H](CC(=O)N(C)CCc1cccs1)c1ccncc1 160897913 OXDZJSUNPZQEOD-ZDUSSCGKSA-N 288.416 3.338 70 20 CGID CC(C)CC(C)(C)CNC(=O)NC1C[C@@H](C)O[C@H](C)C1 159695412 HERVFNNYEYTHGC-CHWSQXEVSA-N 284.444 3.314 70 20 CGID O=C(N[C@H](c1ccccc1)c1ccncc1)C1=CCCC1 159540058 LMFJTKJGHTWNBC-QGZVFWFLSA-N 278.355 3.398 70 20 CGID Clc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)s1 159540757 DCBCARBPKXHMRL-WXHSDQCUSA-N 283.824 3.449 70 20 CGID Fc1cc(Cl)ccc1CNC[C@@H]1CCN(C2CC2)C1 160767165 PYWMDGZXFRPDPM-NSHDSACASA-N 282.790 3.053 70 20 CGID CN(CC1=CCCOC1)Cc1ccccc1Br 160384524 GMDFXPMGXWPDNC-UHFFFAOYSA-N 296.208 3.228 70 20 CGID COc1ccc(C(=O)N(C)Cc2sccc2C)c(F)c1 218441006 HKEZQTSBFIQOHZ-UHFFFAOYSA-N 293.363 3.476 70 20 CGID CC(C)C[C@@H](CNCc1cccc2cc[nH]c12)N(C)C 218099754 MWBNMMNQPOSUBI-INIZCTEOSA-N 273.424 3.234 70 20 CGID C[C@H]1[C@@H](C)Sc2ccccc2N1Cc1nccn1C 161128942 BWIALLCXSNBBIW-NWDGAFQWSA-N 273.405 3.309 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccc(F)c(F)c2)c1C 161223684 JFIOARLHVBDJJT-UHFFFAOYSA-N 293.317 3.440 70 20 CGID Cc1c(NC(=O)N2CC[C@H](C)[C@H]2C)cnn1CCC(C)C 161315678 QTSRJMGNLIRLDQ-QWHCGFSZSA-N 292.427 3.500 70 20 CGID C[C@@](O)(CNc1cccc(F)n1)c1ccccc1Cl 160163750 HTNYLAAUQGWEIV-CQSZACIVSA-N 280.730 3.194 70 20 CGID Cc1ccc(F)c(OCC(=O)N[C@H]2CCc3ccccc32)c1 160307105 BJVUDTGCPIVOKF-INIZCTEOSA-N 299.345 3.317 70 20 CGID CCCCn1ncc(C(=O)N[C@H]2CCc3ccccc32)c1C 160340057 NOVSVDQFRZQWCK-KRWDZBQOSA-N 297.402 3.409 70 20 CGID Cc1cc(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)no1 160344086 GVBRVTWDJJXNLX-VIFPVBQESA-N 278.739 3.454 70 20 CGID COC(=O)CCN(C(=O)C1CCC(C)(C)CC1)C(C)C 160352792 QWFWZLMKXWZMDH-UHFFFAOYSA-N 283.412 3.003 70 20 CGID CN(C)c1nnc(SCC(=O)CCC2CCCC2)s1 160405201 MICXMAVDTTWWGK-UHFFFAOYSA-N 299.465 3.236 70 20 CGID C[C@@H](NCC1(Sc2ccccc2)CC1)[C@@H]1CCOC1 160479496 CZGAEOFOKMGWSO-ZIAGYGMSSA-N 277.433 3.326 70 20 CGID Cc1ccc2oc(C(=O)N(C)Cc3cccn3C)cc2c1 160631523 ZCNZVVYWXZPAQK-UHFFFAOYSA-N 282.343 3.352 70 20 CGID CCC(CC)n1nc(C(=O)Nc2cccc(F)n2)cc1C 160666529 HCCUGEAERNEUNO-UHFFFAOYSA-N 290.342 3.339 70 20 CGID Cc1occc1C(=O)N[C@H]1CCOC2(CCCCC2)C1 160780134 DEWHMDDGBVSLCH-ZDUSSCGKSA-N 277.364 3.200 70 20 CGID C[C@H](NC[C@@H](C)N1CCc2sccc2C1)c1ccco1 159867089 WIRNREPQIQAGES-OLZOCXBDSA-N 290.432 3.439 70 20 CGID CCOCCC(=O)N1C[C@H](C)CSc2ccccc21 159710805 DWSCVTHGLZGNNZ-LBPRGKRZSA-N 279.405 3.188 70 20 CGID NCc1ccc(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)cc1 159719140 VSWMBTYMIZHLRI-QZTJIDSGSA-N 294.398 3.211 70 20 CGID CN(c1ccccc1)C1CCN(CCOCC2CC2)CC1 159740916 HYIUZKXQDFGZFV-UHFFFAOYSA-N 288.435 3.014 70 20 CGID COc1cc(N[C@H]2CCCc3c2cnn3C)ccc1F 159958528 SYLDYTPLJAKSCE-ZDUSSCGKSA-N 275.327 3.057 70 20 CGID CC1=CCN(C(=O)CCc2c[nH]c3ccccc23)CC1 160176821 BLYVGNGTRGQTIS-UHFFFAOYSA-N 268.360 3.279 70 20 CGID C[C@H]1CN(C(=O)Nc2c(F)cccc2Cl)C[C@@H](C)O1 217313053 CZVMBKRPGGMFTM-DTORHVGOSA-N 286.734 3.120 70 20 CGID CC(C)(CC(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CC1 864239099 XFBSPDLVUMWDIU-UHFFFAOYSA-N 299.367 3.110 70 20 CGID CC[C@H](C)N(C)CCNCc1c(C)cc(C)cc1C 217377510 KQXWMMFQBAINOT-INIZCTEOSA-N 262.441 3.432 70 20 CGID CC[C@H]1CCCCN1C(=O)NCc1ccccc1C 217313768 FYKGCGFRKVUGPP-HNNXBMFYSA-N 260.381 3.469 70 20 CGID CCOCCC1(CNC(=O)C(C)(C)CC)CCC1 161285095 VIXWHDUQCIOEID-UHFFFAOYSA-N 255.402 3.136 70 20 CGID COCCC(=O)N1CCCC[C@H]1CCCc1ccccc1 161179463 UTWKYHUSHWJLSX-KRWDZBQOSA-N 289.419 3.427 70 20 CGID CC(C)CCn1ccc(NC(=O)N2[C@@H](C)CC[C@H]2C)n1 161195820 SWPGXKUIBXYJRE-BETUJISGSA-N 278.400 3.334 70 20 CGID CCO[C@@H]1C[C@@H](N[C@@H](C)c2cnccn2)C1(CC)CC 161300925 OYONRWVISDMMML-NWANDNLSSA-N 277.412 3.111 70 20 CGID CC(C)C[C@@H](C)N(C)C(=O)COc1ccc2[nH]ccc2c1 160024976 CZZIMKUBPDPEMS-CYBMUJFWSA-N 288.391 3.440 70 20 CGID CCCn1nccc1CN[C@H](C)CCc1ccc(O)cc1 160082196 YTIPJIXSPHXGCT-CQSZACIVSA-N 287.407 3.110 70 20 CGID CNC(=O)c1ccc(NC(=O)CC(C)(C)C)c(Cl)c1 160315097 OIQVHKGRNAHPOW-UHFFFAOYSA-N 282.771 3.074 70 20 CGID CC[C@]1(C)CCCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C1 160389248 DKDSJVSULRCRFO-HLLBOEOZSA-N 294.439 3.166 70 20 CGID C[C@@H](CC1CC1)NC(=O)N1CCO[C@H](c2cccs2)C1 160412474 ABLBVBSBXHETHN-AAEUAGOBSA-N 294.420 3.020 70 20 CGID CCC[C@@H](CCc1ccccc1)NC(=O)C[C@H]1CCCN1 160938835 IDAMUDZHLPROPH-DLBZAZTESA-N 288.435 3.046 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)NCCc1cscn1 159444247 NMYQCEBHCMWOJQ-GXTWGEPZSA-N 295.452 3.296 70 20 CGID CC(C)Cn1ncc(C(=O)N[C@H]2C=CCCC2)c1C1CC1 159862717 UOOXPTLPAWYGLI-AWEZNQCLSA-N 287.407 3.255 70 20 CGID COc1ccc([C@@H](C)N[C@H]2CCOC(C)(C)C2)c(F)c1 159952757 LBGFUWGIIPWTGO-NEPJUHHUSA-N 281.371 3.443 70 20 CGID CCCn1nccc1CNCc1ccc(F)c(Cl)c1 160136605 JNTWBFRDRGNWDO-UHFFFAOYSA-N 281.762 3.375 70 20 CGID CS[C@@H](C)CNC(=O)[C@@H](C)Cc1ccc(Cl)cc1 161374875 QSEBOPIJLRQZTD-QWRGUYRKSA-N 285.840 3.386 70 20 CGID O=S(=O)(Cl)C[C@H](F)c1ccc(C(F)(F)F)cc1 1537958585 DIQNKTIBHVEXND-QMMMGPOBSA-N 290.665 3.285 70 20 CGID C[C@@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)C1CC1 161021475 ODMNHTZWNOPZLP-TZMCWYRMSA-N 265.397 3.031 70 20 CGID CCNCC1CCN(C(=O)C[C@H](C)c2ccccc2)CC1 161059142 IBURZCOXEAFLCW-HNNXBMFYSA-N 288.435 3.028 70 20 CGID Cc1ccc(/C=C/C(=O)N[C@@H]2CCOC3(CCCC3)C2)o1 161359656 RSURZEVYKQVKDM-PSKZRQQASA-N 289.375 3.209 70 20 CGID CNC[C@H]1CCCN1C(=O)c1ccc(SC(C)C)cc1 161368441 GLQVQKRIUZGBPA-CQSZACIVSA-N 292.448 3.011 70 20 CGID CC[C@@H](NCC1(c2ccc(F)cc2)CC1)[C@H]1CCOC1 161371616 CXMXSOYOHUOPMV-XJKSGUPXSA-N 277.383 3.262 70 20 CGID CCCN(CCC)CCCNC(=O)Nc1ccc(C)nc1 161476937 CXNYOFRFOYCTDF-UHFFFAOYSA-N 292.427 3.024 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 160164863 QYRAHICTRDCAHN-PBHICJAKSA-N 286.375 3.188 70 20 CGID Cc1ccc2cccc(C(=O)NCC3(C4CC4)CC3)c2n1 160176025 RIAHJMWZHWKBOH-UHFFFAOYSA-N 280.371 3.463 70 20 CGID C[C@H](NCC1(Sc2ccccc2)CC1)c1cnccn1 160486521 BBNDWIYKPGFKDI-ZDUSSCGKSA-N 285.416 3.452 70 20 CGID CCCOc1cccc(NC(=O)N(C)[C@@H]2CCSC2)c1 160508608 LMPBCQWEYNMXMX-CYBMUJFWSA-N 294.420 3.445 70 20 CGID CC(C)(C)c1cnc([S@@](=O)Cc2nccs2)s1 160694084 KJKBWTHJTKJMGH-QGZVFWFLSA-N 286.447 3.205 70 20 CGID Cc1cccc2ncnc(N[C@@H]3CCOC(C)(C)C3)c12 160718367 UVSZEJKTJFWCHB-GFCCVEGCSA-N 271.364 3.308 70 20 CGID CCC(CC)n1ncc(C(=O)N2C[C@@H]3CC[C@@H]2C3)c1C 160721457 SGBXIUMEGCZZDI-TZMCWYRMSA-N 275.396 3.177 70 20 CGID CCC(=O)c1cccc(NC(=O)c2cnn(C(C)(C)C)c2)c1 160739576 NFEJAZSWPSDUOZ-UHFFFAOYSA-N 299.374 3.483 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)NC(C)C)c2C)c1 160806331 FLRUDVRQIMPEAB-UHFFFAOYSA-N 286.379 3.327 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@H](C)c1ccc2ccccc2c1 160935622 CODPHMXGVYUMOC-RDTXWAMCSA-N 299.414 3.467 70 20 CGID CCO[C@H]1CCCN(C(=O)NCC(CC)(CC)CC)C1 159651166 PXDHZUCORFKAOZ-AWEZNQCLSA-N 284.444 3.413 70 20 CGID C[C@H](NC[C@@H](C)N1CCc2ccccc21)c1ccco1 159927634 NOOMFIRROKXLNW-KGLIPLIRSA-N 270.376 3.381 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccccc1Cl 159930197 VMGKCGKNANCYPK-MFKMUULPSA-N 267.756 3.086 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCCO1)c1ccccc1Cl 159930447 VMGKCGKNANCYPK-ZWNOBZJWSA-N 267.756 3.086 70 20 CGID COc1ccc(NC(=O)N[C@@H](C)C2CCC2)cc1OC 159389522 VMYSJIBZMZKBKO-JTQLQIEISA-N 278.352 3.014 70 20 CGID CCCCN(CC)C(=O)CSCc1c(CC)noc1C 159984371 KWUGLLHBAQLLKM-UHFFFAOYSA-N 298.452 3.427 70 20 CGID COc1ccc2c(c1)C[C@H](N[C@H]1CCCSC1)CC2 159567205 OWCZFDXOQTVKDJ-CABCVRRESA-N 277.433 3.038 70 20 CGID Cc1ccccc1NC(=O)CN1CC[C@@H]2CCCC[C@@H]21 159687487 MLVDIARMKPDKKC-HOCLYGCPSA-N 272.392 3.198 70 20 CGID COCCc1nsc(N[C@H]2CCCc3sccc32)n1 161072524 ZGWJCLUORAMUNA-JTQLQIEISA-N 295.433 3.278 70 20 CGID CN(Cc1cccc(Cl)c1)Cc1cnc2cnccn12 161128575 OCKBPBMJKKSXBD-UHFFFAOYSA-N 286.766 3.015 70 20 CGID Cc1ccc(CN[C@@H](C)c2cnn(C(C)C)c2)cn1 161317911 BZVSFPHFIYNVTR-ZDUSSCGKSA-N 258.369 3.018 70 20 CGID CC(C)c1ccc(C(=O)N(Cc2cccnc2)C2CC2)cn1 161399364 FEQDGGQYQWQPGS-UHFFFAOYSA-N 295.386 3.405 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1nnc(C(C)C)s1 160230342 DXIZWXYCVAQMJN-PELKAZGASA-N 253.371 3.036 70 20 CGID CS[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 160278607 PELYTRQKTZWEIT-LBPRGKRZSA-N 278.421 3.367 70 20 CGID CCc1nc(CN[C@H](C)c2ccccc2C(F)(F)F)n[nH]1 160468543 MILYENOFVVEHSA-SECBINFHSA-N 298.312 3.237 70 20 CGID C[C@@H](Cc1cccc(F)c1)C(=O)N(C)Cc1cccn1C 160474685 YOVFUJVAADIIFL-ZDUSSCGKSA-N 288.366 3.001 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CCCc1ccc(Cl)cc1 160826463 PDKQYJIQQOVSBV-HNNXBMFYSA-N 297.826 3.186 70 20 CGID CCCn1ccc2ccc(NC(=O)[C@H]3CC[C@@H](N)C3)cc21 159851667 SUDUIBRIYWTBPN-UONOGXRCSA-N 285.391 3.117 70 20 CGID Cc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159476590 RKYRNDDVDVYYLP-JYJNAYRXSA-N 257.377 3.042 70 20 CGID COC(=O)c1cccc(NC(=O)c2ccc(C(C)C)nc2)c1 159769924 CPCMDRAGRAGJCV-UHFFFAOYSA-N 298.342 3.244 70 20 CGID Cc1cnccc1N[C@H]1CCCc2cc(N)ccc21 159502645 PCXCGMZGDHHINO-INIZCTEOSA-N 253.349 3.462 70 20 CGID CC(C)[C@@H](NCC(=O)Nc1ccc(Cl)cc1)C1CC1 161115074 OGOHVKZGAWIZQO-OAHLLOKOSA-N 280.799 3.303 70 20 CGID C[C@H](CN[C@@H]1C[C@@H](C)N(C)C[C@@H]1C)c1ccccc1 217933885 SVQDQGQKRDKHMJ-JYYAWHABSA-N 260.425 3.108 70 20 CGID COCCCCOc1cc(Br)ccc1F 160644676 OJUHBAJIFMXCMG-UHFFFAOYSA-N 277.133 3.394 70 20 CGID O=S(=O)(Cl)C1=Cc2cc(Cl)cc(Cl)c2OC1 100645354 MTAMNNFJKLWLSO-UHFFFAOYSA-N 299.562 3.295 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1nccs1 160031596 PGKKCHWCWOBDOR-DTWKUNHWSA-N 264.375 3.255 70 20 CGID CC[C@@H](C)[C@H](C)NCc1ccc(OC(C)C)nc1 160039926 GPRJTOSUJBEQEA-OLZOCXBDSA-N 250.386 3.393 70 20 CGID CC[C@H](SC)C(=O)N[C@@H]1CCCc2sccc21 160160923 LLDNWPSCDUQPQL-MNOVXSKESA-N 269.435 3.383 70 20 CGID COC[C@@H](Cc1ccccc1)N[C@H](C)c1ccco1 160197096 PSYFVYHHRYWTNH-UKRRQHHQSA-N 259.349 3.188 70 20 CGID CCc1ccc([C@@H](CO)NC(=O)N[C@@H](C)CC(C)C)cc1 160219475 TYZYSBLDFXIYBL-XJKSGUPXSA-N 292.423 3.016 70 20 CGID Cc1ccc(NC(=O)COc2cc(C)ccc2F)c(O)c1 160345173 HFCCXHNAHPSSEE-UHFFFAOYSA-N 289.306 3.166 70 20 CGID CCN(C)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 160500769 IAGQTTAYPZTOSD-LSDHHAIUSA-N 260.381 3.059 70 20 CGID CCN1CC[C@H](NCCCCc2nc(C)cs2)[C@H](C)C1 160659256 DAKBPLZLBWTDPV-HIFRSBDPSA-N 295.496 3.094 70 20 CGID Cc1nccn1-c1ncccc1NC(=O)[C@H]1CCC[C@@H](C)C1 160982550 FJYTXAINGKFMNF-OCCSQVGLSA-N 298.390 3.341 70 20 CGID O=C(Oc1cccc(C(F)(F)F)c1)[C@@H]1CCCCO1 159465542 BPDDREWULMFVCS-NSHDSACASA-N 274.238 3.180 70 20 CGID CC[C@@H](c1ccccc1)N(CCOC(C)C)CC(=O)OC 159677749 VPQXPHTYUDBQHS-INIZCTEOSA-N 293.407 3.038 70 20 CGID CC[C@H](C)OCC(=O)Nc1ccccc1OCC(C)C 159681446 WMGNXIXDZDSQTP-ZDUSSCGKSA-N 279.380 3.475 70 20 CGID C[C@@H]1CCC[C@H](C(=O)N2CCO[C@H](c3ccccc3)C2)C1 159687587 BROHCDNPAQBBLN-PVAVHDDUSA-N 287.403 3.413 70 20 CGID CCCC1CCC(NC(=O)N(C)C[C@H]2CCC[C@@H]2O)CC1 159921450 ZPYHEHJKVIDROX-KNIAUWFNSA-N 296.455 3.148 70 20 CGID CC(C)CONC(=O)Nc1ccc(N2CCCC2)c(F)c1 159377871 VMIXNQSGKJLHKZ-UHFFFAOYSA-N 295.358 3.135 70 20 CGID O=C(CC1CC1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159383009 BFWOPOSHHRMXAZ-GOEBONIOSA-N 273.376 3.071 70 20 CGID Cn1c(SCC2CCCC2)nnc1-c1ccccn1 159593352 NXPDHIDZGKBGJM-UHFFFAOYSA-N 274.393 3.159 70 20 CGID COc1cc(N[C@H]2CCOC3(CCC3)C2)ccc1F 160298780 OPWZHGQVDIVZTI-LBPRGKRZSA-N 265.328 3.348 70 20 CGID CCc1cc(O)nc(CN2CCC[C@H]2c2ccsc2)n1 160855295 PHDOWHIIZDSNBB-ZDUSSCGKSA-N 289.404 3.143 70 20 CGID Fc1cccc(CNc2ccc(Cl)nn2)c1F 218711997 TUVONSLMIWGPCH-UHFFFAOYSA-N 255.655 3.020 70 20 CGID c1cc(CNCc2ccc3c(c2)OCO3)c2[nH]ccc2c1 218063127 NZFSQAZLIZGYPV-UHFFFAOYSA-N 280.327 3.186 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(F)ccc1F 159740591 WZSZROSSMMPPFQ-TVQRCGJNSA-N 253.292 3.273 70 20 CGID CCCCN(CCOCC1CC1)CC(F)(F)F 159920682 BGQGGPJYWNCZGD-UHFFFAOYSA-N 253.308 3.077 70 20 CGID C[C@H]1CN(C(=O)c2ccc(CN)o2)CC[C@@H]1c1ccccc1 161234816 BRVHSNXLLHAUJA-BBRMVZONSA-N 298.386 3.004 70 20 CGID COC[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)C1CC1 161282649 QAZPNRJFJIREED-XZDPQHSOSA-N 279.424 3.134 70 20 CGID COC[C@@H](NC(=O)Nc1cccc2ccc(C)nc12)C1CC1 160109948 CFGHDTNCZSZERV-OAHLLOKOSA-N 299.374 3.090 70 20 CGID CCCSCC(=O)O[C@H](c1ccccn1)C(F)(F)F 160111657 NARMFPYTLFTHOR-LLVKDONJSA-N 293.310 3.371 70 20 CGID CC[C@H]1CCCCN1CCNC(=O)[C@@H](C)c1cccs1 160247708 COHLDJHDYPBXJG-KBPBESRZSA-N 294.464 3.232 70 20 CGID CC[C@@H](NC(=O)c1sccc1OC)c1c(C)noc1C 160359945 YASCJOSAHWISJX-SNVBAGLBSA-N 294.376 3.243 70 20 CGID Cc1cc(C(=O)NC(C)C)ccc1NC(=O)[C@H]1CC1(C)C 160438631 BYRSSYFFFSJZDV-CYBMUJFWSA-N 288.391 3.118 70 20 CGID Cc1nn(-c2ccccc2)cc1CN[C@H]1CCOC(C)(C)C1 160537110 AVHDUEOMYLXGBA-INIZCTEOSA-N 299.418 3.228 70 20 CGID CCOc1cccc(NC(=O)Cc2c(C)noc2Cl)c1 160668261 MIMXPRJECLZMNT-UHFFFAOYSA-N 294.738 3.216 70 20 CGID Cc1sc(-c2ccco2)nc1C(=O)NC1CC=CC1 160790611 JSJLBDLPUULARB-UHFFFAOYSA-N 274.345 3.160 70 20 CGID Cc1ccc(C(=O)N2CCC(N[C@H](C)C(C)C)CC2)cc1 160980908 MZMFAFGKMVTPID-OAHLLOKOSA-N 288.435 3.234 70 20 CGID C[C@H](NC[C@@H](C)N1CCc2ccccc2C1)c1ccco1 159820073 HOOMTGWQLFIGGG-CABCVRRESA-N 284.403 3.377 70 20 CGID CC1=C(C(=O)N2CCC[C@H]2c2cccs2)CCCO1 159468707 PFVZRLWEAXYPQL-ZDUSSCGKSA-N 277.389 3.496 70 20 CGID CC[C@@H](C)CS(=O)(=O)N(CC)c1ccc(F)c(F)c1 159861565 JNZNTGYQQBZSQK-SNVBAGLBSA-N 291.363 3.167 70 20 CGID CCC(CC)[C@H](O)CNC(=O)c1ccc(Cl)cc1C 160400836 WDIQGCQZCFMKTO-CQSZACIVSA-N 283.799 3.175 70 20 CGID Cc1ccccc1NC(=O)COc1ccc(F)cc1C 160712170 LPLDXUHBAZULIV-UHFFFAOYSA-N 273.307 3.460 70 20 CGID CCOc1ccc(C(=O)N2[C@H]3C=CC[C@H]2CC3)cc1 218695265 PUQWTKOIWSTWEW-KBPBESRZSA-N 257.333 3.018 70 20 CGID O=C(Nc1ccc(S(=O)(=O)F)cc1)C1CCCCCC1 864237759 JQRSPCBHZGPVGY-UHFFFAOYSA-N 299.367 3.254 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCC[C@H](N(C)C)C2)c(F)c1 161016437 YQRBXJWLMRNFDO-IHRRRGAJSA-N 294.414 3.358 70 20 CGID COCCN(CC(C)C)C(=O)[C@@H]1C[C@H]1c1sccc1C 161170810 BGGKANLLTCIEDU-ZIAGYGMSSA-N 295.448 3.291 70 20 CGID CC[C@@H]1CCCC[C@H]1NCc1cnn(C)c1C(F)(F)F 161433228 KONUQQJQHLLILA-ZYHUDNBSSA-N 289.345 3.497 70 20 CGID CCCC1(CNC(=O)NC[C@@H](C)SC)CCC1 160300774 PTYRFSRIVZTJJB-LLVKDONJSA-N 258.431 3.008 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)c1ccc2c(c1)CCCC2 160367346 LVKNOJHVTZAOLE-SUMWQHHRSA-N 293.476 3.330 70 20 CGID CC(C)CC(CC(C)C)NC(=O)N(C)C[C@H]1CCC[C@@H]1O 160761816 WIQGTOGWDRHVAQ-ZBFHGGJFSA-N 298.471 3.250 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)C1CCCCC1 160860256 NQZDUYYQRDBWAK-NSHDSACASA-N 279.405 3.406 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 160989326 KDLJKGUMDRKNQJ-UHFFFAOYSA-N 283.375 3.381 70 20 CGID CC(C)(C)c1ccc(NC(=O)N[C@H]2CC[C@H](O)CC2)cc1 159818530 BVEMGHICWPQVER-GASCZTMLSA-N 290.407 3.409 70 20 CGID CC(C)[C@@H](C)CC(=O)N[C@@H]1CCOC2(CCCC2)C1 159873891 KJZVTIMLGCHQLJ-UONOGXRCSA-N 267.413 3.277 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)N[C@@H](C)c1ccccn1 159508577 HDELJIBAKPQCQU-RWMBFGLXSA-N 286.400 3.432 70 20 CGID COc1ccccc1CN(C(=O)[C@@H]1CC1(C)C)C1CC1 159531012 PIACPMLMLSOGFL-AWEZNQCLSA-N 273.376 3.232 70 20 CGID C[C@@H](NC(=O)Nc1cc(F)ccc1F)C1CCC1 159366598 OYJRXJNEMKNBHE-MRVPVSSYSA-N 254.280 3.275 70 20 CGID C[C@@H](NC[C@@H](C)N(C)Cc1ccccc1)c1cncs1 160862319 DRPAJBUKHALZNH-ZIAGYGMSSA-N 289.448 3.314 70 20 CGID CCC(CC)n1nccc1C(=O)NCCc1ccccc1 161139366 ZTLPPYHKWZHNGS-UHFFFAOYSA-N 285.391 3.217 70 20 CGID CC[C@@H](SC)C(=O)N[C@H]1CCCc2sccc21 160161287 LLDNWPSCDUQPQL-WDEREUQCSA-N 269.435 3.383 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)NC(CC)CC 160074355 YRYDJWKMWPUXKW-LLVKDONJSA-N 298.452 3.472 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)CCOc1ccc(F)cc1 160233522 GUQKDJPFDZTQMM-GDBMZVCRSA-N 279.355 3.099 70 20 CGID CSc1ccc(NC(=O)C[C@@H](C)c2ccncc2)cn1 160370188 ADKKDTPGFQRQBS-LLVKDONJSA-N 287.388 3.331 70 20 CGID Cc1ccc(C)c(-n2ncc(C(=O)N3CCCC3)c2C)c1 160980074 OCXWQNKYWVINCU-UHFFFAOYSA-N 283.375 3.034 70 20 CGID Cc1cc(NC(=O)c2cnn(CCC(C)C)c2C)ccn1 159800758 WSYIKYLNSCPVAZ-UHFFFAOYSA-N 286.379 3.193 70 20 CGID COc1ccc(NC(=O)N[C@H](C)C2CCC2)c(OC)c1 159447414 NMXOJPSRPITXCK-SNVBAGLBSA-N 278.352 3.014 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCC1(C2CC2)CC1 159855827 XGJYUTKOHYAAIW-CHWSQXEVSA-N 275.417 3.466 70 20 CGID Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@H](N)C(C)C 159694733 VDQSLSZIXTUOHB-JKSUJKDBSA-N 276.424 3.182 70 20 CGID CCCc1ccccc1NC(=O)[C@@H]1CCn2ccnc2C1 159711766 QTLHVONHKIYATK-CQSZACIVSA-N 283.375 3.037 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCC3(CCC3)C2)n1 159932696 GTAAUQJLIRWIEB-UHFFFAOYSA-N 290.411 3.337 70 20 CGID CCCc1nc(CN2CCC[C@H]2c2cccc(C)n2)no1 159789405 QFMKRXOMDMPLOI-AWEZNQCLSA-N 286.379 3.063 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cccc(SC)c1 159790549 ALOKTRSGJBEWIB-UHFFFAOYSA-N 296.436 3.329 70 20 CGID CC1(Nc2ccc(S(=O)(=O)C(F)(F)F)cc2)CCC1 159900853 KOVQRFOMMZQRMG-UHFFFAOYSA-N 293.310 3.335 70 20 CGID CCCn1nccc1CN[C@H](C)c1c(F)cccc1F 160095322 XBLLFMOUIUUCGR-LLVKDONJSA-N 279.334 3.422 70 20 CGID NCCCCCCC(=O)N1CCC2(CCCCC2)C1 161195528 SHOWAXYXBVFJLZ-UHFFFAOYSA-N 266.429 3.078 70 20 CGID CCS[C@H]1CCC[C@@H]1NC(=O)c1ccc(Cl)nc1C 160654022 NJHCHGVNBFIWKD-RYUDHWBXSA-N 298.839 3.447 70 20 CGID OCCN(Cc1ccccc1)Cc1ccc(Cl)c(F)c1 218312442 IUSSXZDJLOZZNJ-UHFFFAOYSA-N 293.769 3.474 70 20 CGID FCCCSCc1ccc(-n2cccn2)cc1 161152986 XQKUIEWWCSPWHJ-UHFFFAOYSA-N 250.342 3.465 70 20 CGID CNC[C@H](C)C(=O)N1CCCC[C@@H]1c1cccc(C)c1C 161338223 OMZIZDFRFQKVRE-WMLDXEAASA-N 288.435 3.213 70 20 CGID CNC[C@@H]1CCCN1C(=O)c1ccc(SC(C)C)cc1 161368559 GLQVQKRIUZGBPA-AWEZNQCLSA-N 292.448 3.011 70 20 CGID CNC(=O)c1ccccc1NCCC1=CCCCC1 161398971 RBXYMJDTMHONGL-UHFFFAOYSA-N 258.365 3.349 70 20 CGID CCNC(=O)c1cccc(CNC2[C@@H](C)CCC[C@@H]2C)c1 160187324 VMESGOGNBOTQNQ-KBPBESRZSA-N 288.435 3.351 70 20 CGID Cc1ccc(CNc2cc(C(=O)NC3CC3)ccc2C)nc1 160268236 HDYDVIBRYTXROS-UHFFFAOYSA-N 295.386 3.203 70 20 CGID CC(C)c1ccc(OCCN[C@H](C)c2cnccn2)cc1 160333224 RCMRNSCAUSOIDE-CQSZACIVSA-N 285.391 3.330 70 20 CGID CC(C)COC[C@@H](NC(=O)NC1(C)CCC1)c1ccco1 160398620 HCUCEYOKXXYPRB-CYBMUJFWSA-N 294.395 3.235 70 20 CGID O=[S@](Cc1nccs1)c1ccc(F)c(Cl)c1 160643140 NXCGTBDIPMWOCN-INIZCTEOSA-N 275.757 3.243 70 20 CGID CCC[C@@H](CC)NC(=O)CC(O)(CCC)CCC 160874375 UGHLCRMMGCXCIA-CYBMUJFWSA-N 257.418 3.403 70 20 CGID CC(C)n1nccc1C(=O)N1CCC[C@H]1C1CCCC1 159532620 FFZKYNWLACZJMF-AWEZNQCLSA-N 275.396 3.259 70 20 CGID C[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](c2ccccc2)C1 217727110 FTISYVBWNJAWQR-DZGCQCFKSA-N 275.392 3.206 70 20 CGID C[C@@H]1CCN(C(=O)Nc2cccc(F)c2F)C[C@@H]1C 160465961 NQNHYBNZDKTLHG-ZJUUUORDSA-N 268.307 3.475 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1ccnc(-c2ccccc2)n1 161433403 WJABUFHSPAGCTI-AWEZNQCLSA-N 285.391 3.353 70 20 CGID CCCC(=O)N1CCC[C@H]1C(=O)N(CC)CC(CC)CC 160209873 RQEAJEVNPCRLJU-HNNXBMFYSA-N 296.455 3.062 70 20 CGID Cc1cc(C(=O)N(C)c2ccc3c(c2)OCO3)c(C)s1 160329300 GIXYPZABJSQLIF-UHFFFAOYSA-N 289.356 3.370 70 20 CGID O=C(Oc1ccccc1F)c1csc([C@H]2CCCO2)n1 160480065 PSYWZDUNAGEWJU-GFCCVEGCSA-N 293.319 3.353 70 20 CGID COC[C@@H](C)NCc1cn(-c2ccccc2)nc1C(C)C 160749716 QTWNCBJVPZUDCP-CQSZACIVSA-N 287.407 3.120 70 20 CGID CCC(CC)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160757508 VUOKPBGXOYCPNT-CQSZACIVSA-N 267.413 3.421 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cccc(NC(C)=O)c1C 160925387 VOFBDUAODMTROE-MLGOLLRUSA-N 274.364 3.328 70 20 CGID CC[C@H](Nc1ccn(CCOC)n1)c1ccc(F)cc1 160927376 FIJBMRDRDVRSHF-AWEZNQCLSA-N 277.343 3.232 70 20 CGID CCC(C)(CC)C(=O)NC[C@@H](C)c1ncc(C)s1 159483508 YETOENMWQLVWTO-SNVBAGLBSA-N 268.426 3.498 70 20 CGID Cc1cc(NC(=O)c2ccc(Cl)c(Cl)c2)c[nH]c1=O 159688887 ROCXBKWLFSVWCS-UHFFFAOYSA-N 297.141 3.242 70 20 CGID Cc1cc(C)c(C(=O)Nc2nc3ccccc3s2)[nH]1 159740913 JDDWPHLQZOXLNM-UHFFFAOYSA-N 271.345 3.494 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1ccc(F)cc1F 159777714 VEOPPGOPMIQSLE-TVQRCGJNSA-N 253.292 3.273 70 20 CGID CCCCCOCC[C@H](C)CCS(=O)(=O)Cl 115235222 YHZMZMPFANXFNB-NSHDSACASA-N 270.822 3.178 70 20 CGID C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H](N)C1 217485345 OBOWQDQHJUIGLS-CMPLNLGQSA-N 288.313 3.069 70 20 CGID COc1ccc([C@@H](C)NCCc2ccc3c(c2)OCO3)cc1 161145303 ALBQLMAPFNMYCN-CYBMUJFWSA-N 299.370 3.317 70 20 CGID COCCOc1ccc(NC(=O)N[C@@H](C)C2CCC2)cc1 160591575 MEQBZHQNZNRDEN-LBPRGKRZSA-N 292.379 3.022 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160652620 OJSVDNYQNLHQIW-IIAWOOMASA-N 279.424 3.421 70 20 CGID COC(=O)c1csc(NC(=O)Nc2ccccc2C)c1 160734755 OYFBFNKWYBJHSI-UHFFFAOYSA-N 290.344 3.487 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(-n2ccnc2)cc1 160817084 WMDSCLZERYISCR-HOCLYGCPSA-N 269.348 3.247 70 20 CGID COc1ccc(NC(=O)c2cccn2C(C)C)cc1 160918504 MYUXDQJNPKAFIW-UHFFFAOYSA-N 258.321 3.330 70 20 CGID C[C@H]1CCCN(C(=O)N[C@@H]2CCCc3cc(N)ccc32)C1 159440320 LDSMYQMFZXJNEJ-BLLLJJGKSA-N 287.407 3.088 70 20 CGID Cc1ccccc1[C@@H](C)NCCCOC[C@@H]1CCOC1 159668730 JNZRPXWCOAVQNW-CVEARBPZSA-N 277.408 3.089 70 20 CGID COc1ccc(CN2CCC[C@H]2c2cccc(C)n2)cn1 159711125 PIIHAGSTGKNVLV-INIZCTEOSA-N 283.375 3.131 70 20 CGID CSCCCCC(=O)NCCO[C@H]1CCCC[C@H]1C 159946838 AEZIXVKERVMQEE-KGLIPLIRSA-N 287.469 3.231 70 20 CGID Cc1ccc(CNc2ccc(-c3nnco3)cc2C)cn1 159568927 HOWIFCQEUVFLJG-UHFFFAOYSA-N 280.331 3.361 70 20 CGID CC(C)C[C@H](CCO)CNc1nc(C(C)(C)C)ns1 159780035 XLLWXGQKGDZLHX-NSHDSACASA-N 285.457 3.292 70 20 CGID CCCn1nccc1CN[C@@H](C)Cc1ccc(C)s1 160153850 SDYBEPWSSPQYLA-LBPRGKRZSA-N 277.437 3.384 70 20 CGID CN(Cc1ccc(Cl)c(Cl)c1)Cc1csnn1 161140233 OSQURJDAIBVCKZ-UHFFFAOYSA-N 288.203 3.477 70 20 CGID CC(=O)NC1CCC(Nc2cc(F)cc(Cl)c2)CC1 161133971 VYXPGIRNRLBCHQ-UHFFFAOYSA-N 284.762 3.338 70 20 CGID Cc1nc2ncnn2c(N[C@H]2CCCc3sccc32)c1C 161072283 CPDNBNVXDKNWRR-LBPRGKRZSA-N 299.403 3.292 70 20 CGID Cc1cc(C)c2ncc(C(=O)N3CCC(C)CC3)c(O)c2c1 161141590 OMCNMAQUCBJFIL-UHFFFAOYSA-N 298.386 3.429 70 20 CGID CCCCCN(C(=O)c1cccc(=O)n1C)[C@@H](C)CCC 161265436 DTWQBQGBIWMLDZ-AWEZNQCLSA-N 292.423 3.206 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cc2ccccc2n1C 161458380 PKNNLMAOPLKUNE-VXGBXAGGSA-N 256.349 3.191 70 20 CGID CC(C)NC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F 161509837 KZOIELQXBLCIKJ-SNVBAGLBSA-N 296.239 3.276 70 20 CGID CC1(C)CCC(C(=O)N[C@@H]2CCN(C3CCCC3)C2)CC1 160083757 MILZXVYURLWPKM-OAHLLOKOSA-N 292.467 3.336 70 20 CGID CCc1ncsc1C(=O)N1CCc2c(F)cccc2C1 160804600 OAJCVHCGNWZGDB-UHFFFAOYSA-N 290.363 3.043 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)Cc1ccc(C)nc1 160905618 FGAZBRIGQDIKNN-HOTGVXAUSA-N 274.408 3.360 70 20 CGID CCCC[C@H](N[C@@H](C)c1cccc(F)c1F)C(=O)OC 159489217 FULVVYGJBCOYSX-GWCFXTLKSA-N 285.334 3.347 70 20 CGID CC[C@H](C)c1cc(C(=O)NCC2(C3CC3)CC2)on1 159720660 GHQSEIXEPPTLCI-JTQLQIEISA-N 262.353 3.108 70 20 CGID CCCCCNC(=O)[C@H](C)N[C@@H](C)c1cccc(F)c1F 159533130 NSQWOKIPXBAADP-RYUDHWBXSA-N 298.377 3.310 70 20 CGID CCCn1nccc1CNc1ccc(OC)cc1C 160140034 QYDVLGTWMCXGTN-UHFFFAOYSA-N 259.353 3.222 70 20 CGID CCc1sc(C(=O)Nc2ccc(OC)c(N)c2)cc1C 161150781 SNJKQEIYVIIXDK-UHFFFAOYSA-N 290.388 3.462 70 20 CGID Cc1c(C(=O)NC(C)(C)CCO)oc2ccc(Cl)cc12 161500430 IHNVQWJRPZOAEE-UHFFFAOYSA-N 295.766 3.285 70 20 CGID CCOCCCC(=O)N(C)[C@H]1CCCC[C@H]1CC 161297933 KLLQIHKBBOQZAQ-KGLIPLIRSA-N 255.402 3.230 70 20 CGID C[C@@H](NC(=O)C1CCC(C)(C)CC1)C(C)(C)CN(C)C 161114399 APDDQHVGRQIYSH-CYBMUJFWSA-N 282.472 3.295 70 20 CGID CCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCCCO1 161227623 BYJHNEMXPLBPLH-AWEZNQCLSA-N 281.783 3.258 70 20 CGID C[C@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)[C@@H]1C 160001531 DEXUZCPYTMUGJL-UONOGXRCSA-N 280.456 3.001 70 20 CGID Cc1ccnc(NC(=O)c2ccccc2OCC2CC2)c1 160335766 IDAQOQDFKYYDQO-UHFFFAOYSA-N 282.343 3.431 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)C(=O)NCc1cccs1 160546662 GONRVGPANQWDLT-STQMWFEESA-N 282.453 3.121 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(F)c(NC(C)=O)c1 160840525 UIYDUMRSQZCKBN-ABAIWWIYSA-N 278.327 3.159 70 20 CGID CC1(NC(=O)N[C@@H]2CCN(C3CCCC3)C2)CCCCC1 160874171 OCVNWNFQMFZWPH-CQSZACIVSA-N 293.455 3.025 70 20 CGID Cc1csc(C(C)(C)NC(=O)c2cc(C)c(C)o2)n1 160942943 WVNQKFHGJUGIPM-UHFFFAOYSA-N 278.377 3.326 70 20 CGID CCOC1CC(Nc2cccc(C(=O)N(CC)CC)c2)C1 159826446 PYUFDBJFPDJSNH-UHFFFAOYSA-N 290.407 3.148 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)N(C)Cc2nccn2C(F)F)C1 159900763 AAUIHGAAJWWHNH-GHMZBOCLSA-N 285.338 3.063 70 20 CGID CN(Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1(C)C 159929527 MIFGQJUHKSIDCQ-ZDUSSCGKSA-N 257.333 3.437 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N[C@@H]1CCOC2(CCCC2)C1 159794296 IGAFGRVGBAWXPM-VNHYZAJKSA-N 265.397 3.031 70 20 CGID Fc1ccc2c(c1)[C@H](N[C@@H]1CCCSC1)CC2 159595550 QGPBOZWJPDDPJN-TZMCWYRMSA-N 251.370 3.298 70 20 CGID C1CN[C@@H](c2noc(C3C4CC5CC(C4)CC3C5)n2)C1 160249178 ZRCKXFODYDOARP-RVARXAPGSA-N 273.380 3.034 70 20 CGID CC1CCN(C(=O)N2CCC[C@@H]3CCCC[C@H]32)CC1 160373852 UMCMLVCOJAZTOX-LSDHHAIUSA-N 264.413 3.493 70 20 CGID CC1(C)C[C@@H](NCc2cc(F)c(F)cc2F)CCO1 160561848 SKFBCUJMJGTOAE-JTQLQIEISA-N 273.298 3.151 70 20 CGID CCCCCCOCC(C)(C)CS(=O)(=O)Cl 114472819 ZEAVQJNVHGMPBR-UHFFFAOYSA-N 270.822 3.178 70 20 CGID Cc1cc(C)c(C(=O)NCCN(C)c2ccccc2)c(C)c1 216799241 SMJNZTHJCLSILK-UHFFFAOYSA-N 296.414 3.478 70 20 CGID CCn1nccc1CN(C)CCOc1ccc(Cl)cc1 161158187 YRZFMSRODDYXAM-UHFFFAOYSA-N 293.798 3.067 70 20 CGID Oc1cccc(CN(CCOCC2CC2)CC2CC2)c1 159912508 RONLBRHXXCKHIE-UHFFFAOYSA-N 275.392 3.031 70 20 CGID CC[C@@H](C)N(C)CCNCc1cccc(OC(C)C)c1 217394941 NDOGJNGJDSQRHF-OAHLLOKOSA-N 278.440 3.294 70 20 CGID CCS[C@H](C(=O)NCC1(C2CC2)CC1)C(C)C 160036485 MCNUQOJCLDWJHD-LBPRGKRZSA-N 255.427 3.071 70 20 CGID CSCc1ccc(C(=O)NCC2(C3CC3)CC2)cc1 160198849 XYDZUNWXTUBICV-UHFFFAOYSA-N 275.417 3.470 70 20 CGID Cc1occc1CN(C)C(=O)N[C@H](C)CC(C)C 160831268 MEFBPOVJZNXQCV-LLVKDONJSA-N 252.358 3.164 70 20 CGID O=C(C1CC1)N1CC[C@@H](c2cccc(Br)c2)C1 217253814 DVFQQVDHNPRIEX-GFCCVEGCSA-N 294.192 3.175 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@@H](C)Cc1ccccc1Cl 161117703 QHGMHSMHCFKTGR-GXTWGEPZSA-N 297.826 3.042 70 20 CGID CCc1noc(C)c1CNc1cccc(NC(=O)OC)c1 159405152 XKWLFAUJCJMGHD-UHFFFAOYSA-N 289.335 3.336 70 20 CGID CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCO2)c2ccccc2N1 159812351 YTJLLZSOGUVKIE-ZBFHGGJFSA-N 288.391 3.039 70 20 CGID CSCCCCC(=O)NC[C@H](C)N(C)c1ccccc1 159884298 JDNMJRRUUBDCNW-AWEZNQCLSA-N 294.464 3.161 70 20 CGID CCc1noc([C@@H](C)N[C@@H](C)c2cccc(F)c2F)n1 159513448 NYVJNDLOVBVMPD-DTWKUNHWSA-N 281.306 3.322 70 20 CGID CCCN(C)C[C@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159748238 PZOGHTHCRAQRED-GFCCVEGCSA-N 296.484 3.004 70 20 CGID COc1ccc(CNC2CCCCCC2)cc1NC(C)=O 159984506 IKGLQCDMQMNQJW-UHFFFAOYSA-N 290.407 3.466 70 20 CGID CCC[C@H](NCc1ccc(OC)c(Cl)c1)C(=O)OCC 160459339 OXVYVCZYRQBVBY-ZDUSSCGKSA-N 299.798 3.170 70 20 CGID CC[C@H](NCCOC[C@H]1CCCO1)c1ccc(F)cc1 160931866 GJDTVMSJFDOIQE-CVEARBPZSA-N 281.371 3.062 70 20 CGID CCc1ncnc(Sc2ccc(O)cc2)c1F 217979241 GMBKFLADXXZUKL-UHFFFAOYSA-N 250.298 3.035 70 20 CGID CCCCCCOC[C@@H](CC)CS(=O)(=O)Cl 114472814 FBWYHPWURKJEHW-LLVKDONJSA-N 270.822 3.178 70 20 CGID COc1cc(F)c(C(=O)N[C@H]2CCCC[C@H]2C)cc1OC 161286564 BUPNIGWXLMYBKE-MFKMUULPSA-N 295.354 3.151 70 20 CGID CCc1noc([C@@H](C)SCc2c(CC)noc2C)n1 160005214 ZNFNXMRDHOOSGQ-SECBINFHSA-N 281.381 3.485 70 20 CGID O=C(CCCN1C[C@H]2CCC[C@H]2C1)c1ccccc1 160039081 FLHWJOLJAZMEJK-IYBDPMFKSA-N 257.377 3.381 70 20 CGID CCCNC(=O)c1cccc(CNC(C2CC2)C2CC2)c1 160576960 KTUCQJSGNSYHHJ-UHFFFAOYSA-N 286.419 3.105 70 20 CGID CCOc1ccc(NC(=O)C[C@@H](C)SC)cc1F 160586247 FQCIZGKBVMJJLE-SECBINFHSA-N 271.357 3.305 70 20 CGID COc1ccc(C(=O)N2CC=C(C(C)(C)C)CC2)c(O)c1 160991119 AVOHXSYJEGAHTG-UHFFFAOYSA-N 289.375 3.219 70 20 CGID CN1[C@H]2CC[C@H]1CN(C(=O)C[C@H]1CCCCC1(C)C)CC2 159444127 RZNNDDKSTIOCSQ-PMPSAXMXSA-N 292.467 3.288 70 20 CGID C[C@H]1CCC[C@@H](C(=O)N(C)Cc2nccn2C(F)F)C1 159900864 AAUIHGAAJWWHNH-WDEREUQCSA-N 285.338 3.063 70 20 CGID CC[C@H](C)[C@H](C(=O)N(CC)CCCO)c1ccccc1 160485366 JNTNXQLSTDPCBT-HOCLYGCPSA-N 277.408 3.047 70 20 CGID CCC(N)(CC)CNC(=O)CSc1cc(C)ccc1C 160525782 XBSFUFMVVNAKOI-UHFFFAOYSA-N 294.464 3.029 70 20 CGID CSC[C@H](C)Nc1cc(Cl)nc(C2CC2)n1 159883236 LECRRLQLZRGVIQ-ZETCQYMHSA-N 257.790 3.171 70 20 CGID C[C@H](NCC(C)(C)O)c1cc(Cl)sc1Cl 160614561 KLKNERVOQUIMQT-LURJTMIESA-N 268.209 3.476 70 20 CGID C=CCC1(C(=O)Nc2cccc(S(=O)(=O)F)c2)CCC1 460097017 YROOQKLKGGVZEU-UHFFFAOYSA-N 297.351 3.030 70 20 CGID CCc1ccc(CN(C(=O)[C@H]2CCCCO2)C2CC2)cc1 161025761 XWVMMZDTHOOTDW-QGZVFWFLSA-N 287.403 3.309 70 20 CGID O=C(NC1CCC(c2ccccc2)CC1)[C@@H]1CCCCO1 161046419 UKYPSIWWZJXAHQ-JCYILVPMSA-N 287.403 3.398 70 20 CGID C[C@@H](C(=O)N1CCCC[C@H]1C)c1c(F)cccc1F 161149386 BXCXINRIBWGVLP-GHMZBOCLSA-N 267.319 3.469 70 20 CGID CCc1ccc(-c2ccc(C(=O)N3CCC[C@H]3CN)o2)cc1 160298682 VFABDYLRQFITAM-HNNXBMFYSA-N 298.386 3.072 70 20 CGID O=[S@@](Cc1nccs1)c1ccc(F)c(Cl)c1 160643023 NXCGTBDIPMWOCN-MRXNPFEDSA-N 275.757 3.243 70 20 CGID CC[C@H](C(=O)N(C)Cc1nccs1)c1ccc(F)cc1 160669693 NEDHQEXQLREORD-ZDUSSCGKSA-N 292.379 3.434 70 20 CGID COC[C@@H](NCCCCc1nc(C)cs1)C(C)C 160694966 CPEWONKPEREBBM-CYBMUJFWSA-N 270.442 3.035 70 20 CGID CC1(NC(=O)NCc2cc3ccccc3o2)CCC1 159421472 QDCLFVPIADIECF-UHFFFAOYSA-N 258.321 3.175 70 20 CGID CCc1ccc([C@@H](C)NCc2cn3ccccc3n2)o1 159442047 BBXSKLQFICBPBC-GFCCVEGCSA-N 269.348 3.341 70 20 CGID COc1cccc(SCC(=O)NCC2(C3CC3)CC2)c1 159663212 WZQWXKAYHKNGCE-UHFFFAOYSA-N 291.416 3.094 70 20 CGID C[C@@H](c1cccc(F)c1)N(C)CCOCC1CC1 159768408 NHYOPQNDOHSOLS-LBPRGKRZSA-N 251.345 3.245 70 20 CGID Cc1nc2ccccn2c1CN1[C@H](C)CCC[C@H]1C 159774981 FMNUPIAZWZPQGI-CHWSQXEVSA-N 257.381 3.406 70 20 CGID CCCn1nccc1CNCc1ccc(OC(F)F)cc1 159985674 VDGGRYVBIQNESJ-UHFFFAOYSA-N 295.333 3.184 70 20 CGID CC[C@@H](NC(=O)c1ccc(Cl)o1)c1c(C)noc1C 159999840 TZHZLFWRUMNEDH-SECBINFHSA-N 282.727 3.419 70 20 CGID CC[C@H](CO[C@H](C)CC(C)C)CS(=O)(=O)Cl 114472725 NNUGQIQICIJMON-GHMZBOCLSA-N 270.822 3.032 70 20 CGID CC[C@H]1CCCN1C[C@@H](O)c1cc2ccccc2o1 216866529 CQUVIVNCTKEODA-UONOGXRCSA-N 259.349 3.341 70 20 CGID O=C(c1csc([C@@H]2CCCO2)n1)N1CCCCCCC1 161290007 GLGSPSAZDFJXQP-ZDUSSCGKSA-N 294.420 3.401 70 20 CGID O[C@@H](C1CCN(CCC2CCCC2)CC1)C(F)(F)F 161321461 PGOGXUBBFKUTHY-ZDUSSCGKSA-N 279.346 3.202 70 20 CGID CCOC[C@H]1CCCN(C(=O)/C=C/c2ccc(CC)o2)C1 160018801 POROQNSJXQGBNM-HBWSCVEGSA-N 291.391 3.130 70 20 CGID COc1ccccc1CN(C)Cc1ccccc1NC(C)=O 160424352 FXEHRLKTYBOGNM-UHFFFAOYSA-N 298.386 3.286 70 20 CGID CC(C)C1CCN(Cc2cnc3ccccn23)CC1 160794597 AWDGEZWDFNHWOJ-UHFFFAOYSA-N 257.381 3.202 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccsc1 160882000 DJCDGMGOBJZHOZ-CYBMUJFWSA-N 279.405 3.360 70 20 CGID C[C@@H](C(=O)NCC1(C2CC2)CC1)c1ccccc1F 159730228 XRBFKGQEEUVKBJ-LLVKDONJSA-N 261.340 3.236 70 20 CGID CCCn1ncc(C(=O)Nc2cc(C)ccc2O)c1C1CC1 159368702 PBEPGLMNYJALBX-UHFFFAOYSA-N 299.374 3.437 70 20 CGID CN(Cc1csc2ccccc12)C[C@H]1CCC[C@@H]1O 159684318 SUNZOTGMRFEHAN-DOMZBBRYSA-N 275.417 3.494 70 20 CGID CCc1ccc(OS(=O)(=O)Cc2ccc(F)cc2)cc1 218267035 GHEZZHVLBJSYRB-UHFFFAOYSA-N 294.347 3.297 70 20 CGID CCCCCNC(=O)NCc1ccccc1Br 217314288 OGZBKHZPWVANGP-UHFFFAOYSA-N 299.212 3.439 70 20 CGID C[C@@H](CNC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)N(C)C1CC1 216730026 RDJFICVOSDVNRJ-ILXRZTDVSA-N 294.483 3.438 70 20 CGID C[C@@H]1CCC[C@@H](CNC(=O)c2[nH]nc3ccccc23)C1 218009064 VWRMEIBSRRUEPD-VXGBXAGGSA-N 271.364 3.119 70 20 CGID C[C@@H](c1cc(F)ccc1F)N(C)C(=O)[C@@H]1CCCCO1 161165531 RGDTYCCEPRGFRB-HZMBPMFUSA-N 283.318 3.053 70 20 CGID Cc1cc(C)c2ncc(C(=O)N3CCC[C@H](C)C3)c(O)c2c1 161180379 KJRROUCOZXNZKC-NSHDSACASA-N 298.386 3.429 70 20 CGID Cc1cccc(CNC(=O)c2cccc(C)c2F)c1 161433793 ZBZORSPLMKJQGK-UHFFFAOYSA-N 257.308 3.373 70 20 CGID O=C(C[C@H]1C=CCC1)Nc1cccc(OCCF)c1 160574537 OVNMIIPPLHNNKP-LBPRGKRZSA-N 263.312 3.330 70 20 CGID O=C(NCC1(C2CC2)CCC1)N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 160582031 HHRNTCPUAMHIHX-YESZJQIVSA-N 296.414 3.204 70 20 CGID CCc1ccccc1C(=O)NCCN(C(C)C)C(C)C 160712368 CLFLFHBQUWBYBJ-UHFFFAOYSA-N 276.424 3.098 70 20 CGID Cc1cc(C)c(C(=O)Cn2cnc(C(C)C)cc2=O)c(C)c1 160736517 IWOBOTJZPDHFGC-UHFFFAOYSA-N 298.386 3.175 70 20 CGID Cc1nc2ccccn2c1CN1C[C@H]2CCCC[C@H]2C1 160983315 ZRSNSTHBPLQPNC-GASCZTMLSA-N 269.392 3.265 70 20 CGID O=C(C1[C@@H]2[C@@H]3CC[C@H](C3)[C@@H]12)N1CCc2c(F)cccc2C1 160998345 RBNHQUQOSZAFSS-HOJOPBEUSA-N 285.362 3.003 70 20 CGID CCOc1ccccc1N(C)Cc1ccc(C)cn1 159416732 AWOJBPXLTONRHA-UHFFFAOYSA-N 256.349 3.425 70 20 CGID Cc1ccc2[nH]c(C(=O)Nc3c[nH]c(=O)c(C)c3)cc2c1C 159473724 WTTIBHRBHPABGV-UHFFFAOYSA-N 295.342 3.034 70 20 CGID Cc1nc(NC(=O)c2cccc3c2CCC3)cc(C2CC2)n1 159940115 VDYMBCBNJWKPQU-UHFFFAOYSA-N 293.370 3.403 70 20 CGID CCOCCC1(CN[C@H](C)c2ccncc2)CCC1 159968179 MLNDTXXCWTUMQT-CQSZACIVSA-N 262.397 3.329 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N[C@@H]1CCOC2(CCCC2)C1 159794062 IGAFGRVGBAWXPM-UMVBOHGHSA-N 265.397 3.031 70 20 CGID COc1cc(N[C@@H]2CCO[C@H](C(C)C)C2)ccc1F 160079935 ZHTBFFVMGYDWLL-OCCSQVGLSA-N 267.344 3.450 70 20 CGID C1CC[C@@H]2C[C@H](N[C@H]3CCN(C4CC4)C3)CC[C@@H]2C1 217788933 YYOGRWQRBGSQRW-JJXSEGSLSA-N 262.441 3.172 70 20 CGID CC(C)COc1ccc([C@@H](C)S(=O)(=O)Cl)cc1 309801754 YEBHCZBKYNXCBK-SNVBAGLBSA-N 276.785 3.351 70 20 CGID Cc1nc(C)c(C(=O)N2CCc3c(F)cccc3C2)s1 161082886 RMZXYAPHRPIHAZ-UHFFFAOYSA-N 290.363 3.098 70 20 CGID CN(C[C@H]1CCOC1)C(=O)C[C@@H]1CCCCC1(C)C 161395930 JYYFIFZYSPOXPH-KGLIPLIRSA-N 267.413 3.088 70 20 CGID CC(=O)Nc1cc(NC(=O)Nc2ccc(C)nc2)ccc1C 161462734 ZZSYOVFXUMKSMK-UHFFFAOYSA-N 298.346 3.301 70 20 CGID C[C@@H](NCCOc1ccc(F)cc1F)C1(C)CC1 160090165 MATVRJGBSIBKQI-SNVBAGLBSA-N 255.308 3.122 70 20 CGID NC[C@@H]1CCCN1C(=O)c1ccc(Oc2ccccc2)cc1 160155872 HZNRLFFYDOLXOG-HNNXBMFYSA-N 296.370 3.042 70 20 CGID CCCCn1ncc(C(=O)N[C@@H]2CCc3ccccc32)c1C 160339913 NOVSVDQFRZQWCK-QGZVFWFLSA-N 297.402 3.409 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CC[C@H](C)C[C@@H]1C 160585711 FOAIDFGYZQYZKZ-RYUDHWBXSA-N 299.374 3.306 70 20 CGID C[C@@H](CCc1cccc(C(F)(F)F)c1)NCC(C)(C)O 160625318 PYMJNUXPTFPPDH-NSHDSACASA-N 289.341 3.387 70 20 CGID C[C@H](NCc1ccc(CN(C)C)cc1)c1cncs1 160865145 AQZZXWQRIJACKB-LBPRGKRZSA-N 275.421 3.056 70 20 CGID CCCCS(=O)(=O)N[C@H](CC)c1ccc(F)cc1F 159632557 QVNZZIJCINSVNX-CYBMUJFWSA-N 291.363 3.135 70 20 CGID CSCCCCC(=O)NCCO[C@@H]1CCCC[C@H]1C 159947032 AEZIXVKERVMQEE-ZIAGYGMSSA-N 287.469 3.231 70 20 CGID C[C@H]1CCCC[C@@H]1CN[C@H](C)C(=O)OC(C)(C)C 217770320 ZXAAYTKMHIYGBC-YNEHKIRRSA-N 255.402 3.133 70 20 CGID C[C@@H](Cc1ccco1)NCc1cccc2cc[nH]c12 218090465 YDMRZBMAZZRFAG-LBPRGKRZSA-N 254.333 3.482 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 161014598 LWIMUMAJCGDKNN-ZFWWWQNUSA-N 292.354 3.213 70 20 CGID C[C@H]1CC(NC(=O)Nc2ccc3[nH]ccc3c2)C[C@H](C)O1 160169738 UOMQBZLUKAPAGB-QWRGUYRKSA-N 287.363 3.245 70 20 CGID CC(C)CCN(C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1)C1CC1 160292966 SNOYSEIHOHPGNK-GDBMZVCRSA-N 294.439 3.164 70 20 CGID CN(Cc1cccn1C)C(=O)C(C)(C)Cc1ccccc1 160573236 NVNSKRFSFLZDEJ-UHFFFAOYSA-N 284.403 3.252 70 20 CGID CN(C(=O)N[C@H]1CCO[C@H](C2CC2)C1)C1CCCCCC1 160630468 PVNLZTVAWMGRBU-HOCLYGCPSA-N 294.439 3.308 70 20 CGID CCOCCC1(C(=O)NCCc2cccs2)CCC1 160639856 GGFCPHKDICBFKX-UHFFFAOYSA-N 281.421 3.004 70 20 CGID COc1c(C)cnc(Cn2c(C)nc3c2CCCC3)c1C 160736133 FYKHHMPBVFOLEF-UHFFFAOYSA-N 285.391 3.139 70 20 CGID COCC[C@@H](C)NCc1ccnc(O[C@H](C)CC(C)C)c1 160832551 KJKLANFKLJJFED-HUUCEWRRSA-N 294.439 3.410 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(OC)cs1 159791715 HIPDWJOUCVZGTN-KOLCDFICSA-N 253.367 3.065 70 20 CGID C[C@H](NC(=O)CC1CCNCC1)c1ccc(F)cc1Cl 159628237 FFKLJZMBOAAEIH-JTQLQIEISA-N 298.789 3.046 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2noc(C(C)C)n2)n1 159738383 ATLHIDLKCSPBOX-CQSZACIVSA-N 286.379 3.234 70 20 CGID Cc1c(/C=C/C(=O)Nc2ccc(OC(C)C)cc2)cnn1C 159957178 PJGTYJBAAYEUFP-BJMVGYQFSA-N 299.374 3.168 70 20 CGID CCOC(=O)CC1CCN(C(=O)[C@@H]2CCC[C@H](C)C2)CC1 159984574 SXRKIEQLVKMQME-DZGCQCFKSA-N 295.423 3.005 70 20 CGID Cc1ccc(CNCc2cccc3c2NCCC3)cn1 159412215 MSQNPFPHQHJPTF-UHFFFAOYSA-N 267.376 3.038 70 20 CGID Cc1cccc(OC[C@H](O)CN[C@@H]2CCC[C@@H](C)[C@@H]2C)c1 217540794 JNDJXGQEXDSVIH-KYHPRHEASA-N 291.435 3.149 70 20 CGID CCCCS(=O)(=O)c1ccc(C(F)(F)F)cc1 216848707 KQKRYCRRJJIBEV-UHFFFAOYSA-N 266.284 3.279 70 20 CGID Cc1c(C(=O)N2[C@H]3C=CC[C@H]2CC3)cnn1-c1ccccc1 218739836 JYTZDHUNEGHYEX-GJZGRUSLSA-N 293.370 3.114 70 20 CGID Clc1cnn(Cc2noc(C3CCCCC3)n2)c1 159825383 GAKYWALEBKJZOF-UHFFFAOYSA-N 266.732 3.016 70 20 CGID FCCCSc1ccc(Br)cn1 161349795 PGECOMPHRMHUEF-UHFFFAOYSA-N 250.136 3.296 70 20 CGID Cc1nn(-c2ccccc2)c(C)c1CN[C@@H]1CCSC1 218619151 BGEJMSXIIFZCID-CQSZACIVSA-N 287.432 3.084 70 20 CGID CS[C@H](C)CNC(=O)[C@@H](C)Cc1ccc(Cl)cc1 161374600 QSEBOPIJLRQZTD-WDEREUQCSA-N 285.840 3.386 70 20 CGID O=C(NCc1ccc(CO)cc1)Nc1cccc(Cl)c1 217275460 ZGKMIBAZMOOHEW-UHFFFAOYSA-N 290.750 3.154 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H](C)c1ccc(C)o1 161208665 QTNBVCQJUDQTBQ-UONOGXRCSA-N 250.386 3.113 70 20 CGID O=C(COc1ccc2[nH]ccc2c1)N1CCc2ccccc21 160043895 UWQQBXMDOXDRIL-UHFFFAOYSA-N 292.338 3.136 70 20 CGID CCCc1noc(CN2CCC[C@H]2c2cccc(C)n2)n1 160123909 YFCOIGQPVWZXHT-AWEZNQCLSA-N 286.379 3.063 70 20 CGID CC(C)C1CCN(C(=O)N[C@H]2CCO[C@H](C3CC3)C2)CC1 160279712 OFGBOKNQGRZOON-HOTGVXAUSA-N 294.439 3.022 70 20 CGID CN(Cc1cccn1C)C(=O)Cc1ccc2c(c1)CCCC2 160364927 HWEFPBFOWQWMCB-UHFFFAOYSA-N 296.414 3.105 70 20 CGID Cc1ccc(C(C)(C)C(=O)Nc2cccc(F)n2)cc1 160584985 HDOYOPKALWDQSC-UHFFFAOYSA-N 272.323 3.445 70 20 CGID CC(C)(C)SCCCC(=O)N1CC[C@H]2OCCC[C@@H]2C1 160740081 RXPWPRFMEDPJAM-ZIAGYGMSSA-N 299.480 3.326 70 20 CGID Cc1ccc(C(=O)N2CCC(OC(C)(C)C)CC2)c(O)c1 160856054 XBZXIPNKBDURHT-UHFFFAOYSA-N 291.391 3.120 70 20 CGID CC(C)Oc1c(Cl)cccc1NC(=O)[C@H]1CCCNC1 160922617 RUWXZMPQGIAGAV-NSHDSACASA-N 296.798 3.065 70 20 CGID CC[C@H](C(=O)NC[C@H]1CCCS1)c1ccc(F)cc1 160990108 DBCWUSWUHZNPOL-KGLIPLIRSA-N 281.396 3.331 70 20 CGID COc1ccc(N(C)C(=O)c2cc(C)oc2C)cc1F 159805604 AZZFSHPZXOSCPD-UHFFFAOYSA-N 277.295 3.321 70 20 CGID Cc1nc(COC(=O)c2ccnc(Cl)c2)c(C)s1 159611652 NEVDTEHSJUEAOK-UHFFFAOYSA-N 282.752 3.165 70 20 CGID COc1cc(C)ccc1CN[C@@H](C)c1ccccn1 159364771 ZQPMQGGDAVNWOC-ZDUSSCGKSA-N 256.349 3.249 70 20 CGID COCC[C@@H](C)N[C@@H]1CCCc2cc(F)ccc21 159553438 LEXDIIYUYZRMOT-IAQYHMDHSA-N 251.345 3.218 70 20 CGID COc1ncccc1CNCc1coc2ccccc12 159817330 UMCDOQQCYMJMAG-UHFFFAOYSA-N 268.316 3.126 70 20 CGID Cc1cccc(CC[C@@H](C)NCC2(CO)CCCC2)c1 160122857 CVHCLUPRPLEOMP-MRXNPFEDSA-N 275.436 3.458 70 20 CGID COc1cc(NC(=O)c2cc(C)ccc2O)ccc1F 160408112 QQXFIDFDOHOCGA-UHFFFAOYSA-N 275.279 3.101 70 20 CGID CCc1ccc([C@H](C)N[C@@H](C(=O)OC)[C@H](C)CC)cc1 218058332 XWXRULOYNUERHL-DVOMOZLQSA-N 277.408 3.487 70 20 CGID OCCN(Cc1ccccc1)Cc1cccc(Cl)c1F 218312793 MACJOEBIJOBCOH-UHFFFAOYSA-N 293.769 3.474 70 20 CGID CC[C@H](C)NC(=O)c1cccc(CN[C@H](C)C(C)C)c1 161067265 NFFNWOZCWADXCV-UONOGXRCSA-N 276.424 3.349 70 20 CGID CC[C@@H](SCCC(N)=O)c1ccc(F)cc1F 161368282 JZUSNLOHHITOKP-LLVKDONJSA-N 259.321 3.025 70 20 CGID CCOCCCN(CC)Cc1c(F)cccc1F 160181317 WBEXFSLFQOVQAM-UHFFFAOYSA-N 257.324 3.213 70 20 CGID CS[C@@H](C)CC(=O)N[C@H]1CCCc2sccc21 160201378 JJJPNBOEWVRGQI-ONGXEEELSA-N 269.435 3.383 70 20 CGID CC[C@@H](NC(=O)CC1CCC1)c1c(C)noc1C 160264257 RUUMRKLYDACEOU-GFCCVEGCSA-N 250.342 3.049 70 20 CGID CCc1nc(Cl)c(C)c(N[C@H]2CCO[C@@H](C3CC3)C2)n1 160469603 WOQUYEQEKJYTSA-NWDGAFQWSA-N 295.814 3.370 70 20 CGID C[C@H](NCc1ccc(CN(C)C)cc1)c1cncc(F)c1 160886661 PVBCJWDOPIDPOT-ZDUSSCGKSA-N 287.382 3.133 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)CCC(C)C)n1 160919290 DLURAAKIHSHLOE-UHFFFAOYSA-N 286.379 3.409 70 20 CGID Cc1ccccc1[C@@H](C)NCCNC(=O)CC1CCCC1 159404320 BSYZHDZLGUEEJR-OAHLLOKOSA-N 288.435 3.342 70 20 CGID C[C@H](C(=O)NCCNC1CCCCCC1)c1cccs1 159659455 HPDBXXQDIIZWSL-ZDUSSCGKSA-N 294.464 3.280 70 20 CGID CC(=O)c1c(F)cc(F)cc1OCc1noc(C(C)C)n1 159867229 IYMCRRGYTZBDEH-UHFFFAOYSA-N 296.273 3.253 70 20 CGID COC(=O)c1ccsc1NC(=O)C[C@@H]1CC[C@@H](C)C1 159382756 LBDBFXCIOQOZSV-NXEZZACHSA-N 281.377 3.300 70 20 CGID CCOC(CCN[C@H](C)CCc1ccccc1)OCC 159541154 MTHZKTHAYZSEML-OAHLLOKOSA-N 279.424 3.387 70 20 CGID Cc1cccc(C(=O)NCCCc2cn[nH]c2C)c1Cl 160384294 JMAJLDTZYHJDDM-UHFFFAOYSA-N 291.782 3.043 70 20 CGID CC[C@H](NCc1cnn(C)c1C)c1ccc(F)cc1 161307916 DRIGCPZXFOUJCC-HNNXBMFYSA-N 261.344 3.109 70 20 CGID C[C@@H](CNCc1cccc2cc[nH]c12)CN1CCCCC1 218119516 DOYKTYKAMLQDIE-HNNXBMFYSA-N 285.435 3.380 70 20 CGID COc1ccc(Cl)c(N[C@@H]2C[C@@H](C)N(C)C[C@@H]2C)c1 218052174 DIUICAGOWFFMNE-MISXGVKJSA-N 282.815 3.489 70 20 CGID CCC[C@@H](C(=O)NC[C@H](c1ccco1)N(C)C)C(C)C 161053752 SSPNIMNGDIQESP-ZIAGYGMSSA-N 280.412 3.071 70 20 CGID CCC[C@@]1(C)CCCN(C(=O)NCC2(CCOC)CC2)C1 161072643 MROPKOJPTRJECO-INIZCTEOSA-N 296.455 3.415 70 20 CGID CCC[C@@H](C)C(=O)N[C@H](CC)c1c(C)noc1C 160484634 CTEAFERUUTYKOI-BXKDBHETSA-N 252.358 3.295 70 20 CGID CC(C)(C)C(=O)NCCc1csc(C(C)(C)C)n1 160645099 PTMNZWDHYJXSPS-UHFFFAOYSA-N 268.426 3.145 70 20 CGID CC[C@H](CC(=O)N[C@@H](CO)CC(C)C)c1ccc(C)cc1 160854496 LDTPNFGSVSJJIW-NVXWUHKLSA-N 291.435 3.402 70 20 CGID Cc1cc(NC(=O)c2ccc(C(C)C)nc2)sn1 159883330 KDYGNBOSAVJGTP-UHFFFAOYSA-N 261.350 3.222 70 20 CGID O=C(Oc1ccc2ccccc2c1)[C@H]1CCCCO1 159382626 KCZDALLZDVWIBM-OAHLLOKOSA-N 256.301 3.314 70 20 CGID CN1CC[C@@H](Nc2cc(Cl)cc(C(F)(F)F)c2)C1=O 159763340 JVCFXYVHKCUVJA-SNVBAGLBSA-N 292.688 3.001 70 20 CGID COc1ccc(C(=O)N[C@H](c2ccccc2)C2CC2)c(O)c1 217566632 GUGXBEYDBMBLAB-QGZVFWFLSA-N 297.354 3.282 70 20 CGID CCOc1ccc(CNC(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 217300854 LSFULEIQHVWSSF-KBPBESRZSA-N 290.407 3.273 70 20 CGID C[C@@H](c1ccccc1Cl)N(C)CCn1ccnc1 159763009 AGQJQPDKWKTKJL-LBPRGKRZSA-N 263.772 3.230 70 20 CGID Cc1cc([B-](F)(F)F)c(C)cc1Br 198309342 QRTXUGZPXLIJKU-UHFFFAOYSA-N 251.862 3.120 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCC[C@@H](C)C2)n1 161002806 AZTZSWJNTYWVRR-CYBMUJFWSA-N 278.400 3.193 70 20 CGID CCN(C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)[C@@H](C)C(C)C 161120723 CSQGHYTZBMJUNM-XQLPTFJDSA-N 294.439 3.020 70 20 CGID C[C@@H]1CCC[C@H](C(=O)NC[C@@H](C)CN2CCCCC2)C1 161212410 RPSIEGSTCSOSFN-OAGGEKHMSA-N 280.456 3.051 70 20 CGID CCc1ccc([C@H](C)CC(=O)N[C@@H]2CCC[C@H](N)C2)cc1 161244654 KBKBTMAJQGNAIQ-XOKHGSTOSA-N 288.435 3.129 70 20 CGID Cc1cccc(C)c1CS[C@H](C)C(=O)NC1CC1 161379521 GHYXSNHKZNOIRI-GFCCVEGCSA-N 263.406 3.204 70 20 CGID CC[C@@H](C)OCC(=O)N1CCC[C@@H]1c1cccc(C)c1 160212035 DBCYDINVIXNZOK-GDBMZVCRSA-N 275.392 3.474 70 20 CGID CC(C)(C)c1ccc(S(=O)(=O)Nc2ccncc2)s1 160334853 FUJGTKGVCLFGKH-UHFFFAOYSA-N 296.417 3.241 70 20 CGID COCCOc1cc(C)ccc1NC(=O)C[C@@H](C)SC 160443957 ZHOIQIAUROSNCS-GFCCVEGCSA-N 297.420 3.100 70 20 CGID c1cc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c2cc[nH]c2c1 159572024 WVOHFQQIMWZUEM-OIISXLGYSA-N 282.387 3.215 70 20 CGID C[C@@H](O)C[C@H]1CCCCN1CCCc1ccccc1 159981391 PYUXLTSCNVWTBE-NVXWUHKLSA-N 261.409 3.245 70 20 CGID Fc1cccc(NCc2ccc3ncccc3c2)n1 159915084 DGECJUROTFJXMO-UHFFFAOYSA-N 253.280 3.381 70 20 CGID CCCn1nccc1CNc1ccc(C)cc1OC 160102818 RFZCXVLHBDSMIE-UHFFFAOYSA-N 259.353 3.222 70 20 CGID COC(=O)C1(NCc2cccc(Cl)c2)CCCCC1 217096938 HLCVXUXERBCOHM-UHFFFAOYSA-N 281.783 3.306 70 20 CGID c1ccc([C@H](N[C@H]2CCSC2)c2ccccn2)cc1 218593320 KXSPKDPQBCQSNL-HOCLYGCPSA-N 270.401 3.266 70 20 CGID CC(C)N(CC1CCN(C(=O)C(C)(C)C)CC1)C(C)C 161384436 IGQQJDFBRUCNTQ-UHFFFAOYSA-N 282.472 3.390 70 20 CGID CCc1ccccc1NC(=O)NCC(CC)(CC)CO 160107564 FYNVCWVKIJACAU-UHFFFAOYSA-N 278.396 3.169 70 20 CGID CSC[C@H](CCO)N[C@@H](Cc1cccc(C)c1)C1CC1 160393831 VMADDRGWTZAAHE-IRXDYDNUSA-N 293.476 3.020 70 20 CGID CC[C@H](NC(=O)c1cc(F)ccc1F)c1c(C)noc1C 160680280 VRUOCTFNRKUEGN-ZDUSSCGKSA-N 294.301 3.451 70 20 CGID CC[C@@H](NCCCCc1nc(C)cs1)[C@H]1CCOC1 160695527 FEPDJTVHCHHRAS-UONOGXRCSA-N 282.453 3.179 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)[C@@H](C)CC1CCCCC1 160850120 YSLMWSRRCOCZJE-QWHCGFSZSA-N 283.412 3.051 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)C[C@H]1C=CCC1 160870664 OYPFQNNVKLYRKY-NEPJUHHUSA-N 277.389 3.182 70 20 CGID C[C@H]1C[C@H](NC[C@@H]2CCc3ccccc32)[C@H](C)CN1C 160972516 DGQHNIJNJANJDM-OAOQPFQOSA-N 272.436 3.035 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)n1 159610803 YNYVSZLDUALIGB-BBBLOLIVSA-N 281.425 3.061 70 20 CGID CCc1ccccc1NC(=O)CN1CC[C@@H]2CCCC[C@@H]21 159639951 WGYOLTYXGCCTLZ-RDJZCZTQSA-N 286.419 3.452 70 20 CGID O=C(/C=C/SCc1ccco1)NCC1(C2CC2)CC1 159650162 MHPPJJGYOMSZJT-WEVVVXLNSA-N 277.389 3.333 70 20 CGID CC[C@@H](NC(=O)c1ccc(OC)cc1)c1c(C)noc1C 159995458 HRWYBBPVRVYORC-CQSZACIVSA-N 288.347 3.181 70 20 CGID CCOCCCN1CCO[C@@H](c2ccccc2Cl)C1 160561409 SIABNSOERNFFIK-OAHLLOKOSA-N 283.799 3.140 70 20 CGID COc1ccc(O)c(NC(=O)c2cccc(Cl)c2F)c1 159927348 WFDVQIJUSJGWRW-UHFFFAOYSA-N 295.697 3.446 70 20 CGID Cc1nn(C)cc1CN(C)Cc1ccc(C(C)C)cc1 160667098 DRJMDHAONRHQCN-UHFFFAOYSA-N 271.408 3.484 70 20 CGID COC(=O)c1ccnc(NC[C@@H]2CCC[C@H](C)C2)c1 217929340 UVYJNYUUWBAEKH-NWDGAFQWSA-N 262.353 3.106 70 20 CGID c1coc(-c2cc(Cn3nc(C4CC4)nc3C3CC3)no2)c1 161438239 DMSASCHMXUMKPV-UHFFFAOYSA-N 296.330 3.329 70 20 CGID C[C@H](N[C@@H](C)c1ccco1)c1ccc([S@@](C)=O)cc1 160204356 QBXAIQXRPLQNGP-ZKTNFTSUSA-N 277.389 3.429 70 20 CGID CC(C)C1CCN(C(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)CC1 160279845 OFGBOKNQGRZOON-HZPDHXFCSA-N 294.439 3.022 70 20 CGID Cc1cscc1NC(=O)Nc1ccc(-n2cccn2)nc1 160761527 JDLJXJFPABJAOI-UHFFFAOYSA-N 299.359 3.281 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CC(F)(F)F 160935131 OVNOVYXRQZFLSM-UWVGGRQHSA-N 251.292 3.366 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C2[C@H]3CCC[C@@H]23)n1 160963908 TZXFMYVLJYZHID-YWXMQNBFSA-N 296.374 3.019 70 20 CGID Cc1cccc(N(C)Cc2cnc3ccccn23)c1 159611963 GJGPGUPVGUAJNN-UHFFFAOYSA-N 251.333 3.279 70 20 CGID COc1ccc(C(=O)N(C)c2ccc(OC)c(F)c2)cc1 159468484 BHQUDJYDKLYCHP-UHFFFAOYSA-N 289.306 3.120 70 20 CGID C[C@@H]1CCC[C@H](NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)[C@@H]1C 159471898 XTIZOGZWMDPJQW-HPCJDURASA-N 294.439 3.068 70 20 CGID CC[C@@H](OC(=O)CCCC(=O)OC)c1cccc(OC)c1 159689179 MCBFZSFRHIQSIC-CQSZACIVSA-N 294.347 3.033 70 20 CGID Cc1ccccc1CNC(=O)N1CC[C@H](C)[C@H](C)C1 159890387 TXKSLSPVOFRITM-GXTWGEPZSA-N 260.381 3.183 70 20 CGID Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1C 159658920 KFJBNYODJVJEHF-BBWFWOEESA-N 271.404 3.351 70 20 CGID CS[C@H]1CC[C@@H](Nc2ccc(C(F)(F)F)nn2)C1 218045269 LVFFQXGGAPDVAH-SFYZADRCSA-N 277.315 3.191 70 20 CGID CCc1noc(C)c1C[S@](=O)c1ccc(C)c(C)c1 161038809 NZGGRFPHWKXSLK-LJQANCHMSA-N 277.389 3.470 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)NCCCC1CCCCC1 160012380 KUPAZFWGBUELCK-XJKSGUPXSA-N 279.424 3.468 70 20 CGID CSC[C@H](CCO)N[C@@H](CCc1ccccc1)C(C)C 160350776 AORYMRAEGVOEQO-IRXDYDNUSA-N 295.492 3.347 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@@H]2CC23CCOCC3)c1 160717873 AHXLZPUGQHJEQW-AWEZNQCLSA-N 287.359 3.035 70 20 CGID Cc1ccccc1C1(C(=O)N(C)Cc2cccn2C)CC1 160805477 AJSWKGLCRLMBNV-UHFFFAOYSA-N 282.387 3.024 70 20 CGID CCC[C@@H]1[C@@H](C)CCCN1C(=O)NCCc1cscn1 159478817 YSPVAXDOIKSKFE-GXTWGEPZSA-N 295.452 3.296 70 20 CGID C[C@@H](Cc1cccc(Cl)c1)C(=O)N[C@H](C)C1CC1 159702110 WFOSXBQCSZVCLY-WDEREUQCSA-N 265.784 3.433 70 20 CGID COC(=O)c1ccc(NC(=O)N[C@H](C)CC(C)C)cc1 159977642 ITIRDWMLAGBHNR-LLVKDONJSA-N 278.352 3.029 70 20 CGID CCOC(=O)[C@H]1CCCN(Cc2cc(Cl)ccc2F)C1 218306108 ILWWEPMFRHIJFL-NSHDSACASA-N 299.773 3.254 70 20 CGID CNC[C@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C 161295148 FXUINKBGIIXIHI-UOVKNHIHSA-N 294.826 3.009 70 20 CGID Cc1c(CCC(=O)N(C)c2cccc(C(C)C)c2)cnn1C 160031495 UJMFIUMJXDDSLL-UHFFFAOYSA-N 299.418 3.448 70 20 CGID CC(C)OC(=O)CCCNc1ccnc(-c2ccccc2)n1 160252126 YNPGKEIXILECSR-UHFFFAOYSA-N 299.374 3.287 70 20 CGID C[C@@H](NC(=O)Nc1cccc(Cn2cccn2)c1)C1CCC1 160569211 OOGMTVRABJFIOY-CYBMUJFWSA-N 298.390 3.242 70 20 CGID Cc1cnccc1CCNC(=O)NCCCCC(C)(C)C 160786868 RLCVBHBQYRRIOR-UHFFFAOYSA-N 291.439 3.448 70 20 CGID O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1ccc(F)c(F)c1 159955845 YCKKNGGGRYQKKH-CKEIUWERSA-N 299.320 3.281 70 20 CGID CCC(C)(C)OCC[C@@H](C)CCS(=O)(=O)Cl 116049671 MCUIWDGNWZAPIL-SNVBAGLBSA-N 270.822 3.177 70 20 CGID Cc1ccc2cc(CN[C@@H]3CCN(C)[C@@H](C)C3)ccc2n1 218365418 YRMMAWVBIRMILQ-WMLDXEAASA-N 283.419 3.116 70 20 CGID Cc1cccc([C@H]2CCCN2CCN2CCCCC2)n1 159780815 ZXEFXRXHBXVUKJ-QGZVFWFLSA-N 273.424 3.013 70 20 CGID C[C@H](CO)SCc1cc(F)cc(Br)c1 160814114 UXFAHYWYXDCDCB-SSDOTTSWSA-N 279.174 3.202 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@H](C)CC1CCCCC1 161157447 QMONLDUPIZFYCW-UKRRQHHQSA-N 269.429 3.116 70 20 CGID CCCCn1c(SCc2ccnn2C)nc(C)c1C 161327019 VQCSHURSIZCWJF-UHFFFAOYSA-N 278.425 3.326 70 20 CGID CCO[C@@H](C)c1nccn1Cc1ccc(F)c(F)c1 161453330 UPWSMZGUIKMNAL-JTQLQIEISA-N 266.291 3.307 70 20 CGID CCc1cccc(NC(=O)NCC(CC)(CC)CO)c1 160001230 OYZCRDCOTYFRAW-UHFFFAOYSA-N 278.396 3.169 70 20 CGID CC[C@H](NC(=O)Cc1cccc(C)c1)c1c(C)noc1C 160193062 INEDHGWQSRDISC-HNNXBMFYSA-N 286.375 3.410 70 20 CGID CC[C@H](C)CN(CC)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160232666 WYUJWQQMQRFIIB-CFVMTHIKSA-N 282.428 3.022 70 20 CGID Cc1nc(NC(=O)CCC(C)(C)C)cc(C2CC2)n1 160266025 GFKCNQJXGBAORT-UHFFFAOYSA-N 261.369 3.427 70 20 CGID CCCCn1ncc(NC(=O)N2CC[C@@H](CC)C2)c1C 160274175 KQUNASAVIALTMZ-CYBMUJFWSA-N 278.400 3.255 70 20 CGID CCOC(=O)N(C)C1CCN(CCC2CCCC2)CC1 160318986 QPNNVKHJFZYZIB-UHFFFAOYSA-N 282.428 3.119 70 20 CGID C[C@H](NC(=O)Nc1ccccc1N(C)C)C1CCC1 160402654 QOZHOUIYPMBSQQ-NSHDSACASA-N 261.369 3.063 70 20 CGID CC[C@H](NC(=O)[C@@H](CC)SC)c1c(C)noc1C 160575766 PJPBQVMQBKRPRJ-WDEREUQCSA-N 270.398 3.000 70 20 CGID Cc1cc(C(=O)N(C)Cc2cccn2C)nc2ccccc12 160626800 SJFFDGWIXHKLGX-UHFFFAOYSA-N 293.370 3.154 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccc2ccccc2c1 160741954 OMZGWWHADVIJGA-UHFFFAOYSA-N 278.355 3.451 70 20 CGID CS[C@@H](C)CC(=O)NCc1ccccc1OCC(C)C 160769444 LLJJTLPMZXZHSG-ZDUSSCGKSA-N 295.448 3.479 70 20 CGID CC[C@@H](c1ccc(Cl)cc1)N(C)C[C@H](O)C1CC1 160847496 BNBMNBZDQGKYCD-GJZGRUSLSA-N 267.800 3.494 70 20 CGID CC(C)C[C@@H]1CCN(Cc2cnc3ccccn23)C1 160910769 CCUAVJFZBRJABX-AWEZNQCLSA-N 257.381 3.202 70 20 CGID CCOCCC1(C(=O)N[C@@H]2CCCC[C@H]2C)CCC1 160954216 LTKBWGSCWNYRQT-ZIAGYGMSSA-N 267.413 3.278 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cccc(-n2cccn2)c1 159626489 RNSPQVMNRJOVDP-CJNGLKHVSA-N 283.375 3.181 70 20 CGID CC(C)CC(C)(C)CNC(=O)N(C)CC1CCOCC1 159695559 AIUGRPPUMSKTDW-UHFFFAOYSA-N 284.444 3.127 70 20 CGID COc1cc(OC)nc(N[C@@H]2CCCc3sccc32)n1 159786482 OZZWOLNHJMGOEH-SNVBAGLBSA-N 291.376 3.045 70 20 CGID C[C@H](O)C[C@@H]1CCCCN1CCCc1ccccc1 159981089 PYUXLTSCNVWTBE-RDJZCZTQSA-N 261.409 3.245 70 20 CGID COc1ccc(CNC2(C)CCC2)cc1OC(F)F 159922568 NZMUVVWBYXTJEZ-UHFFFAOYSA-N 271.307 3.329 70 20 CGID C[C@H](NCCCN1CCCC[C@H]1C)c1cncc(F)c1 160276472 AQQLPOAZGDOVLX-KGLIPLIRSA-N 279.403 3.136 70 20 CGID Fc1cc(Cl)cc(CN2CCC(NCC3CC3)CC2)c1 161153846 VLCQQWARHQFOGO-UHFFFAOYSA-N 296.817 3.443 70 20 CGID CCOC(=O)[C@H](NCCc1cccs1)c1ccccc1 217669842 CXAIDXMTBGFPMN-OAHLLOKOSA-N 289.400 3.185 70 20 CGID CCCN(CCO)Cc1ccc2cc(OC)ccc2c1 161199487 YSVBINHCUMHUNJ-UHFFFAOYSA-N 273.376 3.053 70 20 CGID CNC(=O)c1cnc(/C=C/c2ccc(Cl)s2)s1 161259393 PEYLYGIZMLVINQ-HWKANZROSA-N 284.793 3.388 70 20 CGID CC(C)(C)CN(CCCO)c1nc2cc(F)ccc2o1 161283191 SWYOHMYOLRPLNJ-UHFFFAOYSA-N 280.343 3.202 70 20 CGID Cc1ccc(C[C@H](C)NC(=O)NC2(C)CCC2)s1 161420910 HBPCNSZZMBAZFB-JTQLQIEISA-N 266.410 3.229 70 20 CGID CC[C@@H](COC)NCCSc1ccc(Cl)cc1 160085624 LUUMOILHXOBKOO-LBPRGKRZSA-N 273.829 3.447 70 20 CGID CCC1CCC(CNC(=O)N(C)C[C@@H]2CCC[C@@H]2O)CC1 160109876 RWKUIASZOVXCQN-CKUJCDMFSA-N 296.455 3.005 70 20 CGID C[C@H]1CCCC[C@H]1OCCNC(=O)N1CCC2(CCC2)C1 160426531 QHLRBVXUKAHQHY-LSDHHAIUSA-N 294.439 3.167 70 20 CGID CC[C@H](C)OCC(=O)N[C@@H](c1ccccc1)C(F)(F)F 160478778 XZEUTJQYCAORGS-GWCFXTLKSA-N 289.297 3.221 70 20 CGID CN(C)C[C@H]1CCCCN1C(=O)C1CCC(C)(C)CC1 159418425 NVCNCBRGFOSVKT-OAHLLOKOSA-N 280.456 3.146 70 20 CGID Cc1cc(NC(=O)CCc2ccc(C(C)C)cc2)c[nH]c1=O 159635305 ASXHDYDNLZDUIF-UHFFFAOYSA-N 298.386 3.378 70 20 CGID CCC1(CNC(=O)N[C@@H](C)c2nccs2)CCCC1 159364226 ZCHMAWJWIUWMJH-NSHDSACASA-N 281.425 3.474 70 20 CGID O=C(NCCc1ccco1)c1cncc(-c2ccccc2)c1 159797867 NNMITJDMFYOAHL-UHFFFAOYSA-N 292.338 3.314 70 20 CGID O[C@@H]1CCCCC[C@H]1NCc1cccc2cccnc12 159415205 YMDZXGIIYWCBLS-HZPDHXFCSA-N 270.376 3.018 70 20 CGID CN(C)[C@@H]1CCC[C@@H](N[C@@H]2CCc3ccc(F)cc32)C1 161080524 UYVVPMKYYKJZCN-BFYDXBDKSA-N 276.399 3.275 70 20 CGID CCc1ncnc(N[C@H]2CCC[C@H](SC)C2)c1F 218024292 OFOMQWCBJQQRGH-UWVGGRQHSA-N 269.389 3.264 70 20 CGID FC(F)(F)c1ccc(NCCCOCC2CC2)nc1 218647473 RJUXHQWGJPETBJ-UHFFFAOYSA-N 274.286 3.329 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cccnc1OC 161160849 PZCTZJZDODRZOB-OCCSQVGLSA-N 276.380 3.131 70 20 CGID C[C@H](CC(=O)N1C[C@H]2CCCC[C@H]2C1)c1ccncc1 161294172 TWTDRXGJNTYMTB-BMFZPTHFSA-N 272.392 3.224 70 20 CGID C[C@@H](NCC1(CO)CCCC1)c1cccc(OC(F)F)c1 160094203 JOAOKQKVNMCXRT-GFCCVEGCSA-N 299.361 3.491 70 20 CGID COCCC1(C(=O)NCc2ccc(C)c(F)c2)CCCC1 160245893 OMVMJQXQCLNXPZ-UHFFFAOYSA-N 293.382 3.347 70 20 CGID CCc1ccc(-c2ccc(C(=O)N3CCC[C@@H]3CN)o2)cc1 160298558 VFABDYLRQFITAM-OAHLLOKOSA-N 298.386 3.072 70 20 CGID CN(Cc1cccn1C)C(=O)/C=C/C1CCCCC1 160402773 ZXUPORXHFORDKZ-ZHACJKMWSA-N 260.381 3.120 70 20 CGID CC(C)(O)CN[C@@H]1CCC[C@@H]1CCc1ccccc1 160652254 CIKQNZHMZQZUCZ-HZPDHXFCSA-N 261.409 3.148 70 20 CGID CC[C@@H](NC(=O)C[C@H]1CCCN1)C(C)(C)c1ccccc1 160763172 WBBFIBXCEMNCEU-HZPDHXFCSA-N 288.435 3.001 70 20 CGID CC(C)Oc1cccc(Cn2cnc(C(C)C)cc2=O)c1 160784898 PLHMITFIUAFVNW-UHFFFAOYSA-N 286.375 3.202 70 20 CGID C[C@H]1C[C@@H]1c1cc(NC(=O)c2ccn(C3CCCC3)n2)[nH]n1 159681635 CJARMIJZYVGOFT-JQWIXIFHSA-N 299.378 3.097 70 20 CGID C[C@@H](CC(=O)NCC1(N)CCCCC1)c1cccc(F)c1 159546760 HHYLXDUXKSLMCM-ZDUSSCGKSA-N 292.398 3.097 70 20 CGID C[C@H](NC(=O)Nc1c(F)cccc1F)C1CCC1 159380642 KLXJNFNUCIGFQI-QMMMGPOBSA-N 254.280 3.275 70 20 CGID CCOC(CCNCC(C)(C)c1ccccc1)OCC 159536588 VGFCHMSNVJJNDC-UHFFFAOYSA-N 279.424 3.343 70 20 CGID O=C(NCCc1ccccc1F)NC1CCCCCC1 217353649 QGXRXMFLWXLDSC-UHFFFAOYSA-N 278.371 3.390 70 20 CGID C=CCC1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CCC1 191950245 AJFATGLRSKUDIS-UHFFFAOYSA-N 297.351 3.030 70 20 CGID CCS[C@@H]1CC[C@@H](N(C)C(=O)NC2CCCC2)C1 161434686 QUGKYBCQPZZCQD-CHWSQXEVSA-N 270.442 3.245 70 20 CGID C[C@H]1CCC[C@H](CNCc2cn3ccccc3n2)C1 218237588 VOCDKRXHKMFZDT-KBPBESRZSA-N 257.381 3.250 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1 161059190 ZPZBBNCQULBWTA-IUODEOHRSA-N 292.354 3.213 70 20 CGID CC[C@@H]1CCCC[C@H]1NCC[S@@](=O)c1ccccc1 161424490 QRJUJLRELVUDKV-OGWOLHLISA-N 279.449 3.353 70 20 CGID CC[C@@H]1CCCCN1CCNC(=O)[C@@H](C)c1ccsc1 160247836 VDGSJKUARUSACA-DZGCQCFKSA-N 294.464 3.232 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)N[C@@H]1CCCc2sccc21 160385282 KFDDLFVEHHIAHK-SCDSUCTJSA-N 291.416 3.247 70 20 CGID COc1ccc(NC(=O)N[C@@H](C)CC(C)C)cc1F 160560337 UQCDOCVISGFBGO-JTQLQIEISA-N 268.332 3.390 70 20 CGID Cc1ccc([C@@H](C)NCC[S@@](=O)c2ccccc2)cc1 160789386 GMLBGOZYYAODNF-QRWLVFNGSA-N 287.428 3.453 70 20 CGID CCn1nc(C)c(CN(C)Cc2ccc(OC)cc2)c1C 159857747 RDUDGIAFLODEGD-UHFFFAOYSA-N 287.407 3.160 70 20 CGID CCCC[C@@H](N[C@@H](C)c1cccc(F)c1F)C(=O)OC 159489352 FULVVYGJBCOYSX-GXFFZTMASA-N 285.334 3.347 70 20 CGID C[C@@](O)(CN[C@H]1CCc2ccccc21)c1ccsc1 159932426 GTBVZLJXFDFIKW-JKSUJKDBSA-N 273.401 3.233 70 20 CGID C[C@@H](SCCN1CCOCC1)c1cccc(Cl)c1 159936026 BKBWGHDEONIXQO-GFCCVEGCSA-N 285.840 3.466 70 20 CGID CCSCC[C@@H](C)NC1CCN(c2ccncc2)CC1 160055608 WMJIZSFPBGGFEO-CQSZACIVSA-N 293.480 3.172 70 20 CGID Cc1csc(Cc2nccn2Cc2ccccc2)n1 160642414 QIFAMTDDHWXNQI-UHFFFAOYSA-N 269.373 3.287 70 20 CGID CC(C)N1CC[C@@H](CNCc2cc(F)cc(Cl)c2)C1 160910106 BNDCJIHKFLOZPO-LBPRGKRZSA-N 284.806 3.299 70 20 CGID CCOc1ccc(CNC(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 217300853 LSFULEIQHVWSSF-ZIAGYGMSSA-N 290.407 3.273 70 20 CGID C[C@@H](C(=O)O[C@@H](c1ccccn1)C(F)(F)F)C1CC1 160250382 DIRBVVQZQWEEEY-KCJUWKMLSA-N 273.254 3.274 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1cccs1 160653901 VRPAUYPZZBBQNC-UHFFFAOYSA-N 277.393 3.236 70 20 CGID CCCC[C@H](C(=O)OC)N1CC[C@@H](c2ccccc2)C1 218202860 LVZZMGVXSHNERB-HZPDHXFCSA-N 275.392 3.208 70 20 CGID CC(C)n1nccc1C(=O)N[C@@H]1C[C@@H]1C1CCCCC1 160098710 YVOPKFANUKIUPE-ZIAGYGMSSA-N 275.396 3.163 70 20 CGID CC[C@@H](NCCOc1cccc(Cl)c1)c1cnn(C)c1 160250816 YQUZFZBMKHDMAY-OAHLLOKOSA-N 293.798 3.193 70 20 CGID COc1ccc(N(C)C(=O)c2ccccc2O)cc1Cl 160254694 MINHSJGYQPRLJQ-UHFFFAOYSA-N 291.734 3.331 70 20 CGID CCn1cc([C@@H](C)N[C@H](CCCO)c2ccccc2)cn1 160812967 JMHOHANQQXIYOV-RHSMWYFYSA-N 287.407 3.067 70 20 CGID CC[C@]1(C)CCCN(Cc2cnc3ccccn23)C1 160865021 AGSNQMDWIPYCMN-MRXNPFEDSA-N 257.381 3.346 70 20 CGID CC(C)n1nccc1C(=O)N1C[C@@H](C)CCC[C@H]1C 159490875 USJSJWSIRCVLEY-QWHCGFSZSA-N 263.385 3.115 70 20 CGID CCc1noc(C)c1CSCc1cccc(C(N)=O)c1 159699986 YTMXAQGQONQTQB-UHFFFAOYSA-N 290.388 3.078 70 20 CGID Cc1n[nH]c(C)c1NC(=O)Cc1ccc(F)cc1Cl 159959525 KGDPVMXXZQZNRO-UHFFFAOYSA-N 281.718 3.000 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCCC[C@H]2OC)cc1 160094439 KVLCDICXPXCMCD-VBNZEHGJSA-N 263.381 3.303 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCN1C1CCCC1)c1ccccc1 217937499 VVELMJUFCUENGZ-RHSMWYFYSA-N 286.419 3.271 70 20 CGID CC(C)[C@@H](COCc1ccccc1)CS(=O)(=O)Cl 114476892 KUOTWXTUYYEFEL-ZDUSSCGKSA-N 290.812 3.044 70 20 CGID CCNCC1CCN(C(=O)[C@H]2C[C@H]2C2CCCCC2)CC1 161009063 LPFLHDUTRMZDLR-IRXDYDNUSA-N 292.467 3.051 70 20 CGID C[C@@H]1Sc2ccccc2N(Cc2nccn2C)[C@@H]1C 161128598 BWIALLCXSNBBIW-NEPJUHHUSA-N 273.405 3.309 70 20 CGID CCc1ncc(NC(=O)N(C)[C@@H]2CCCC[C@@H]2CC)cn1 161137478 LEHXOTDEWACCNI-GXTWGEPZSA-N 290.411 3.472 70 20 CGID Cc1cccc(C)c1CS[C@H](C)C(=O)N(C)C 161387741 XYGYITRMWLSIPX-GFCCVEGCSA-N 251.395 3.013 70 20 CGID CC[C@H]1CCCC[C@H]1NC[C@H](O)Cc1ccccc1 161422954 FKYCYLXXFQTKTI-GVDBMIGSSA-N 261.409 3.148 70 20 CGID CC(C)(C)C[C@H](CO)Nc1ncnc2cc(F)c(F)cc12 161435454 KYOROUGXUMOCNC-SECBINFHSA-N 295.333 3.117 70 20 CGID COc1ccc(N(C)C(=O)CC[C@@H]2CCOC2)cc1Cl 160029839 VFUIIQNUFCWYOE-LLVKDONJSA-N 297.782 3.128 70 20 CGID Cc1nnc(NC(=O)C[C@H]2CCCCC2(C)C)s1 160161783 RKYMFDZAFVBWRZ-SNVBAGLBSA-N 267.398 3.392 70 20 CGID Cc1cc(C(=O)Nc2cccc(OCCC(C)C)c2)ncn1 160292677 XFVFWQUHZARIHV-UHFFFAOYSA-N 299.374 3.462 70 20 CGID CCC(CC)n1nccc1C(=O)NCCC(C)C 160556445 NCLNJAHLIPIPNM-UHFFFAOYSA-N 251.374 3.020 70 20 CGID Cc1cnc(C)c(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160630740 MAGNVFOYSBEVAH-HZPDHXFCSA-N 283.375 3.426 70 20 CGID CCc1cc(NC(=O)c2ccc(F)c(Cl)c2)nc(C)n1 160980777 UCJPFRPGNWQGPV-UHFFFAOYSA-N 293.729 3.392 70 20 CGID CCOC(C)(C)CNc1cccc(C(F)(F)F)n1 159514863 CLENDOQMJNNYRR-UHFFFAOYSA-N 262.275 3.327 70 20 CGID CO[C@H](CNC(=O)Nc1ccnc(C)c1Cl)C(C)(C)C 159919109 BEQUEEMEGWRQCH-LLVKDONJSA-N 299.802 3.226 70 20 CGID CC[C@@H](NC(=O)C[C@H]1C=CCC1)c1c(C)noc1C 159948098 XDLNODNHPANNGR-QWHCGFSZSA-N 262.353 3.215 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(-c2cccnc2)on1 159591976 XMTDKIXEHHPZHW-AAEUAGOBSA-N 285.347 3.045 70 20 CGID Cc1cc(CNC(=O)N2CCC3(CCC3)C2)ccc1F 159596797 JGAXWFUTNTWGIM-UHFFFAOYSA-N 276.355 3.220 70 20 CGID CCOc1ccc(CNC(=O)N2CCC[C@@H](C)C2)cc1 217300875 KKHYAVBDTOJWBA-CYBMUJFWSA-N 276.380 3.027 70 20 CGID Cc1ccccc1CCNC(=O)NCC1CCCCC1 217609293 KUULKDUFMOCZSR-UHFFFAOYSA-N 274.408 3.417 70 20 CGID CCOc1ccccc1N(C)CCOC(C)(C)C 159410551 AZKOZSJWCUZWER-UHFFFAOYSA-N 251.370 3.337 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cccnc1OC 161160962 PZCTZJZDODRZOB-JSGCOSHPSA-N 276.380 3.131 70 20 CGID COc1cc(F)c(C(=O)NC2CCCCCC2)cc1OC 161236228 PGVBISHNQZJJGG-UHFFFAOYSA-N 295.354 3.296 70 20 CGID Cc1cccc(C(=O)N(Cc2ccccn2)C2CC2)c1F 161415200 TZIUJSPMRCZFJQ-UHFFFAOYSA-N 284.334 3.334 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@@H](C)C[C@H]2CCCO2)c1 160010379 GDQFKXQXFRRANK-KCQAQPDRSA-N 293.407 3.312 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@@H]2CCC[C@H]2C)n1 160486633 XQHPXZYJBPUCOJ-CHWSQXEVSA-N 278.400 3.239 70 20 CGID CC(C)c1ccc(C(=O)Cn2cnc(C(C)C)cc2=O)cc1 160810396 XTWUYVILUNDGRG-UHFFFAOYSA-N 298.386 3.373 70 20 CGID CCc1cc(O)nc(CN(C)[C@H](C)c2ccc(C)cc2)n1 160871272 DXQJCKNUQMOVAX-CYBMUJFWSA-N 285.391 3.246 70 20 CGID CCc1ccc([C@H](CO)Nc2ncnc3sccc23)cc1 160903951 XSIHAEJNYKJLFC-AWEZNQCLSA-N 299.399 3.399 70 20 CGID Cc1cc(C)cc(CSCCCCS(C)(=O)=O)c1 160908289 ACBVPBKLJVNYLY-UHFFFAOYSA-N 286.462 3.361 70 20 CGID CCCCOCCNC(=O)c1ccc(F)c(SC)c1 159637116 CWHUQKVDNZWOOK-UHFFFAOYSA-N 285.384 3.094 70 20 CGID O=C(CCc1cc(F)ccc1F)NCC1(C2CC2)CC1 159880231 YYFJMGYPHTWLGP-UHFFFAOYSA-N 279.330 3.204 70 20 CGID C[C@@H](NC(=O)Nc1c(F)cccc1F)C1CCC1 159380791 KLXJNFNUCIGFQI-MRVPVSSYSA-N 254.280 3.275 70 20 CGID Cc1cccc([C@H](C)C(=O)NCc2nc(C)cs2)c1 159382203 LCWKREGTPZAQLM-LBPRGKRZSA-N 274.389 3.180 70 20 CGID COC(=O)[C@H](C)CSCc1noc(C2CCCCC2)n1 159815634 UEYCNLNBIJGXOD-SNVBAGLBSA-N 298.408 3.160 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccc(F)cc2)c1C 161143881 LJNFPWBFSLDDSJ-UHFFFAOYSA-N 275.327 3.301 70 20 CGID C[C@H]1[C@@H](C)Sc2ccccc2N1CCn1cccn1 161184869 GXMKCUGSRNSTQG-QWHCGFSZSA-N 273.405 3.272 70 20 CGID Cc1ccccc1CNC(=O)COc1ccc2[nH]ccc2c1 160059479 AQDDQVIKZQDCHR-UHFFFAOYSA-N 294.354 3.172 70 20 CGID C[C@@H]1OCC[C@H]1Sc1nc(C(C)(C)C)ns1 160099310 PTLSEMRBVUVHKH-JGVFFNPUSA-N 258.412 3.105 70 20 CGID CCCCCNC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 160293075 NERARBOPOKXEMD-HNNXBMFYSA-N 292.379 3.166 70 20 CGID Cc1ccc(C(=O)Nc2nnc(-c3ccc(C)o3)[nH]2)c(C)c1 160420742 HRXVGKYDWXXFQW-UHFFFAOYSA-N 296.330 3.242 70 20 CGID O=C(Oc1ccccc1F)c1csc([C@@H]2CCCO2)n1 160479935 PSYWZDUNAGEWJU-LBPRGKRZSA-N 293.319 3.353 70 20 CGID CC[C@H](NC(=O)[C@H](C)OCCC(C)C)c1c(C)noc1C 160600608 BZHUAHZQWXJQLQ-KBPBESRZSA-N 296.411 3.310 70 20 CGID CC1(C)C[C@@H](NC(=O)Nc2c(F)cccc2F)CCO1 160807950 BTXRKYGNNXTNJH-VIFPVBQESA-N 284.306 3.044 70 20 CGID CC(C)CSCCCNC(=O)c1ccc2[nH]ncc2c1 160847928 KPKFSMTWHQBUBC-UHFFFAOYSA-N 291.420 3.072 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCCc3sccc32)o1 159823467 RMEUWCORYGSOTD-LLVKDONJSA-N 261.346 3.457 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@@](C)(CC)C1 159826750 PSDNHKUNSZKDHL-OAHLLOKOSA-N 264.417 3.009 70 20 CGID CCN(Cc1ccsc1)Cc1nc2ccccc2c(=O)[nH]1 159914966 NMNSEFVHNRCOPW-UHFFFAOYSA-N 299.399 3.007 70 20 CGID CC[C@H](N[C@@H]1CCCSC1)c1ccc2c(c1)OCCO2 159556469 YGBSUAIOLFGNOK-KGLIPLIRSA-N 293.432 3.394 70 20 CGID CN(C)c1ccc(NC(=O)N2CCc3ccccc32)cc1 217311486 JAYMUWNXXCQQBM-UHFFFAOYSA-N 281.359 3.347 70 20 CGID CCO[C@H]1C[C@H](NCc2cccc3[nH]ccc23)C1(C)C 217892042 TXMZMXBRQFJCLE-HOTGVXAUSA-N 272.392 3.461 70 20 CGID CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1NC(=O)c1cccc(N)c1 217823109 CTFSYHYWKZJULK-KCXAZCMYSA-N 274.408 3.459 70 20 CGID Cc1cccc(C(=O)N2CCc3sccc3C2)c1F 161428130 VQCKCGHDOXYKNI-UHFFFAOYSA-N 275.348 3.394 70 20 CGID CCOc1cccc([C@H](CC)OC(=O)[C@@H]2CCCO2)c1 160165617 VOGLDEFCZWWRRY-GJZGRUSLSA-N 278.348 3.259 70 20 CGID O=C(C[C@H]1CCCCO1)N[C@H]1CCCc2sccc21 160269653 XIYXGCFJXPTOFT-YPMHNXCESA-N 279.405 3.201 70 20 CGID Cc1ccsc1CCCC(=O)N(C)Cc1ccncc1 160336074 VLPKJFQBRLJUEX-UHFFFAOYSA-N 288.416 3.433 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@H]1CC=CCC1 160497002 FZWVOAABOMPOHU-GJZGRUSLSA-N 277.408 3.341 70 20 CGID COC(=O)c1csc(NC(=O)N2C[C@H](C)C[C@@H](C)C2)c1 160772549 CTQGLGXBFRIZSH-NXEZZACHSA-N 296.392 3.045 70 20 CGID O=C(Nc1cccc(F)n1)C1(c2cccc(F)c2)CCC1 160813573 MZXDQLFZHMKXKE-UHFFFAOYSA-N 288.297 3.420 70 20 CGID CC(C)[C@H](C)NC[C@H](C)N1CCc2ccccc2C1 159801337 AIEPUUANOAXRBC-GJZGRUSLSA-N 260.425 3.067 70 20 CGID CCc1ccc(O)c(NC(=O)c2ccc(F)c(OC)c2)c1 159848648 JBOGRHOQIDCYMY-UHFFFAOYSA-N 289.306 3.355 70 20 CGID Cc1cc(NC(=O)CC[C@@H](C)c2ccccc2)c[nH]c1=O 159492011 UJKONOPPBNFCIP-GFCCVEGCSA-N 284.359 3.206 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@@H](C)c1ccccn1 159508145 HDELJIBAKPQCQU-XQQFMLRXSA-N 286.400 3.432 70 20 CGID C[C@@H](NC[C@@H](C)N1CCc2ccccc21)c1ccco1 159927883 NOOMFIRROKXLNW-ZIAGYGMSSA-N 270.376 3.381 70 20 CGID O=C(N[C@H]1C=CCCC1)N1CCc2cccc(F)c2C1 159938766 YNFFXWVYPQIGGQ-ZDUSSCGKSA-N 274.339 3.002 70 20 CGID C[C@H](SCCN1CCOCC1)c1ccc(F)cc1F 159943683 MLBGODKWJJGJJN-NSHDSACASA-N 287.375 3.091 70 20 CGID Cc1nccc(NC(=O)N[C@H]2CCCSC2)c1Cl 159364923 NEZQEOUUTLJLIM-VIFPVBQESA-N 285.800 3.061 70 20 CGID CCOc1ccc(NC(=O)CO[C@@H](C)CC)c(C)c1 159751081 AEMRXAVHZVRRFA-LBPRGKRZSA-N 265.353 3.147 70 20 CGID COC(=O)[C@@H](C)CSC/C=C\c1ccccc1 217356059 FQZCHQKPUVMVIU-PWWFUAJNSA-N 250.363 3.242 70 20 CGID C[C@@H](NC(=O)C1CCC(C)(C)CC1)C(=O)OC(C)(C)C 161264123 PDESJKIECPXUSF-LLVKDONJSA-N 283.412 3.049 70 20 CGID C[C@H](OC1CCCCCC1)C(=O)N(C)Cc1cccn1C 161015613 TWYREFHYSBIOQX-AWEZNQCLSA-N 292.423 3.111 70 20 CGID C[C@@H](CC(=O)N1C[C@H]2CCCC[C@H]2C1)c1ccncc1 161294072 TWTDRXGJNTYMTB-CWRNSKLLSA-N 272.392 3.224 70 20 CGID COc1ccc(C)cc1[C@H](C)NC(=O)C1=C(C)OCCC1 160185520 VLJFUZPHTAWECR-LBPRGKRZSA-N 289.375 3.265 70 20 CGID CN1c2ccccc2C(=O)N[C@@H]1c1coc2ccccc12 160295651 QMAJUNRZWDCAHK-INIZCTEOSA-N 278.311 3.311 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CCCCCNC(C)=O 160867831 OFLHSTHJBIFCAA-CVEARBPZSA-N 296.455 3.110 70 20 CGID C[C@@H](OC1CCCCCC1)C(=O)Nc1ccccc1O 160954226 NGMXOZCODQJTSV-GFCCVEGCSA-N 277.364 3.459 70 20 CGID CC[C@@H](C)OCC(=O)Nc1c(F)cccc1NC1CC1 159623968 HFPOBDNKXRVWBB-SNVBAGLBSA-N 280.343 3.154 70 20 CGID CCc1[nH]nc(NC(=O)c2cc(C)cc(Cl)c2)c1C 159739925 NQHASLPFQDWVJS-UHFFFAOYSA-N 277.755 3.495 70 20 CGID NC(=O)[C@@H](N[C@H]1CCCc2cc(F)ccc21)c1ccccc1 159546931 ZIQLTHIQGKSDSV-IRXDYDNUSA-N 298.361 3.019 70 20 CGID CN(C(=O)c1ccc(Cl)c(F)c1)c1ccccn1 159967343 JNGQZVRLESWMJJ-UHFFFAOYSA-N 264.687 3.151 70 20 CGID COC(=O)c1ccccc1CN1CCC[C@H](C)[C@@H]1C 217611141 NYYGHBMGIISFCN-STQMWFEESA-N 261.365 3.094 70 20 CGID C/C(=C/C(=O)Nc1cccc(S(=O)(=O)F)c1)C(C)(C)C 809282762 ZVNIBSUDODPDRS-NTMALXAHSA-N 299.367 3.276 70 20 CGID CC[C@H](C)OC[C@H](CS(=O)(=O)Cl)C(C)(C)C 114478379 LGKLWQAKOZVSKV-VHSXEESVSA-N 270.822 3.032 70 20 CGID C[C@H](CNCc1ccc(C2CC2)cc1)N(C)C1CC1 217556060 CYGIKOPXIDKUIM-CYBMUJFWSA-N 258.409 3.136 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@@H](C)CC1CCCCC1 161157212 QMONLDUPIZFYCW-DZGCQCFKSA-N 269.429 3.116 70 20 CGID CCCC1(CNC(=O)Nc2ccc([S@@](C)=O)cc2)CC1 161417083 HGMMTQDYKFKCRR-FQEVSTJZSA-N 294.420 3.126 70 20 CGID COc1cc(C2(C(=O)Nc3ccnc(C)c3)CC2)ccc1C 160065588 SVHWDALEAUNBHP-UHFFFAOYSA-N 296.370 3.377 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)NC(C1CC1)C1CC1 160433322 LXDYCAZHVZDWBN-STQMWFEESA-N 275.417 3.465 70 20 CGID CC[C@@H](NC(=O)C[C@@H]1CCCN1)C(C)(C)c1ccccc1 160762906 WBBFIBXCEMNCEU-JKSUJKDBSA-N 288.435 3.001 70 20 CGID CCC1(C(=O)N2CCc3c(F)cccc3C2)CCC1 160888466 MPLYGWMFLVDRCP-UHFFFAOYSA-N 261.340 3.291 70 20 CGID CS(=O)(=O)CCCCSCCCc1ccccc1 160905256 GPULCTBHTXLTIU-UHFFFAOYSA-N 286.462 3.177 70 20 CGID CCOCCCN[C@@H](c1ccccc1)c1nccs1 159827268 IMBCPQDHQLERLZ-AWEZNQCLSA-N 276.405 3.249 70 20 CGID C[C@H](NC[C@@H](C)N1CCc2ccccc2C1)C1(C)CC1 159829190 JXGOXZHNKCTKGK-CABCVRRESA-N 272.436 3.211 70 20 CGID Cc1cc(NC(=O)c2cc(C(C)C)on2)cnc1Cl 159882328 HHESTKNLOPODTL-UHFFFAOYSA-N 279.727 3.407 70 20 CGID CCC[C@@H](C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159537844 XQMLKWAZWCSFCE-OLZOCXBDSA-N 253.386 3.031 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)Oc1ccccc1 159735789 YVSKURMDTFYEIC-UMVBOHGHSA-N 261.365 3.149 70 20 CGID CCC1(CNC(=O)NC2C[C@@H](C)O[C@H](C)C2)CCCC1 159997618 VFQMGFPANZOXSG-CHWSQXEVSA-N 282.428 3.212 70 20 CGID CSc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159477222 JZDBZMMZYIOQDX-OAGGEKHMSA-N 289.444 3.456 70 20 CGID CCC(CC)CNC(=O)N(C)[C@H](C)CCSC 160574297 VVRLKMNYIOERSV-LLVKDONJSA-N 260.447 3.206 70 20 CGID CCC[C@@H](C)N(C)C(=O)c1cccc(Br)n1 217717116 AUPSUTAABNBMIQ-SECBINFHSA-N 285.185 3.105 70 20 CGID CCc1ccccc1NC(=O)NCC(C)(C)[C@H](O)C(C)C 161038979 XTDCHRTVJJJOLL-OAHLLOKOSA-N 292.423 3.414 70 20 CGID CCO[C@H]1C[C@@H](N[C@H](CC)c2cnn(C)c2)C1(CC)CC 161291701 RUYHKXVJQVEZOE-OAGGEKHMSA-N 293.455 3.445 70 20 CGID CC[C@@H](S[C@H](C)C(=O)N(C)C)c1ccc(F)cc1 161355639 WUWAAHYNALNLRY-ZWNOBZJWSA-N 269.385 3.487 70 20 CGID CCc1ccc(/C=C/C(=O)N2CCOCC23CCCC3)o1 161439653 QHGWHZSETQQAFN-BQYQJAHWSA-N 289.375 3.027 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)C[C@H](CC)c1ccccc1 160415064 KHMFOICAQJEJKR-KGLIPLIRSA-N 291.391 3.028 70 20 CGID CCC(=O)c1cccc(NC(=O)c2[nH]c(C)cc2C)c1 160717046 IOHYUBSQEDCKFT-UHFFFAOYSA-N 270.332 3.477 70 20 CGID CC[C@@H](NC(=O)C[C@H](C)c1ccncc1)c1ccncc1 160784925 LKFSKDAOEQPGOM-XJKSGUPXSA-N 283.375 3.238 70 20 CGID C[C@H](N[C@@H]1CCCSC1)c1ccc(F)cc1N(C)C 159622680 LIWNNUSKPUBIRU-WCQYABFASA-N 282.428 3.438 70 20 CGID CC[C@@H](NCCCN1CCCC1=O)c1ccc(C)cc1 159479672 GAWYPWKHLLAQOY-MRXNPFEDSA-N 274.408 3.048 70 20 CGID CCC(CC)[C@H]1C[C@H](N[C@@H](C)CCn2cccn2)CCO1 159496493 OGOPAYLUYGQQPN-USXIJHARSA-N 293.455 3.235 70 20 CGID CCc1ccccc1NC(=O)N[C@H](CC)[C@@H]1CCCO1 159522610 JJONILMEGUYFMX-HIFRSBDPSA-N 276.380 3.328 70 20 CGID CC[C@@H](NC(=O)[C@H]1CCC[C@H](N)C1)c1ccc(F)cc1F 159727512 AYVLEHFBMSYGIZ-ITDIGPHOSA-N 296.361 3.050 70 20 CGID CCCCn1ncc(NC(=O)N2C[C@H]3CCC[C@@H]3C2)c1C 159921038 IESGLLGLXPJSSI-ZIAGYGMSSA-N 290.411 3.255 70 20 CGID CC[C@H](C)C(=O)Nc1cc(F)ccc1OC(F)F 159395466 BAUZSMVKUTZOBL-ZETCQYMHSA-N 261.243 3.412 70 20 CGID NC1(CNC(=O)c2csc3ccccc23)CCCCC1 159608014 MJHDTBHWZRBZCV-UHFFFAOYSA-N 288.416 3.293 70 20 CGID O=C(NCCCCc1ccccc1)NCC1CCCC1 217579274 FELTVIKOGQICLL-UHFFFAOYSA-N 274.408 3.499 70 20 CGID CSc1ccccc1NC1CCC(NC(C)=O)CC1 161126129 ZQTNHBDWCOLPCX-UHFFFAOYSA-N 278.421 3.268 70 20 CGID COc1cccc(Cl)c1CNC1C[C@H](C)O[C@@H](C)C1 218146091 LVHPOPCOFRUBAK-QWRGUYRKSA-N 283.799 3.394 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cc(F)ccc1F 161019829 HASNSYCWBQBDHU-BNOWGMLFSA-N 282.378 3.488 70 20 CGID CSC[C@@H]1CCCN1C(=O)C[C@@H](C)c1c(C)noc1C 160530900 SVAJIANZWJISGK-MFKMUULPSA-N 296.436 3.139 70 20 CGID CCCC[C@H](CC)CC(=O)N[C@@H](CCO)C(C)C 160561797 RCNFUDPAVXBSLW-KBPBESRZSA-N 257.418 3.116 70 20 CGID CCc1nc(CN[C@@H](c2cccc(C)c2)C(F)(F)F)n[nH]1 160731648 WSFVIMABEIBQGQ-ZDUSSCGKSA-N 298.312 3.069 70 20 CGID C[C@@H](CCn1cccn1)Nc1ccc(-n2ccnc2)c(F)c1 159424334 PCCSYXYCHBEGIJ-ZDUSSCGKSA-N 299.353 3.099 70 20 CGID CCN(CCn1ccnc1)Cc1ccccc1Cl 159739936 OMYAMCAINXIRCX-UHFFFAOYSA-N 263.772 3.059 70 20 CGID Cc1occc1CN(C)C(=O)C[C@@H](C)c1ccncc1 159386713 SKYIGEYVQUQBCT-GFCCVEGCSA-N 272.348 3.135 70 20 CGID CC1(C)C[C@@H]1C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 159598253 HXFIFHVXRJLYPE-FVQBIDKESA-N 287.403 3.317 70 20 CGID CC1(C)C[C@@H](NCc2ccc3ncccc3c2)CCO1 160444058 HBJCHMSBGUSAFD-HNNXBMFYSA-N 270.376 3.282 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCC[C@H](N(C)C)C2)cc1 161112544 RSAOBSSNCRNSLX-BPUTZDHNSA-N 276.424 3.219 70 20 CGID CCOc1ccc(CC(=O)OCCC(C)C)cc1 217473270 CXYYXWNDGQAYBA-UHFFFAOYSA-N 250.338 3.217 70 20 CGID C[C@H](c1ccccc1Cl)N(C)CCn1ccnc1 159763130 AGQJQPDKWKTKJL-GFCCVEGCSA-N 263.772 3.230 70 20 CGID CC(=O)c1cccc2c1CN(C(=O)OC(C)(C)C)CC2 218563514 WTKBFXKXEKQLHS-UHFFFAOYSA-N 275.348 3.182 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1ccccc1 161135156 KCLRGGKBWIFYHU-UHFFFAOYSA-N 271.364 3.174 70 20 CGID COCCC1(CNC(=O)N2CCC[C@@H](C(C)C)CC2)CC1 161145152 KDBXFTOEDIKNLB-OAHLLOKOSA-N 296.455 3.271 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCc1cccc(C(=O)NC)c1 161415425 TWWAXJLJVDUFDO-ZBFHGGJFSA-N 274.408 3.105 70 20 CGID Cc1cc([C@@H]2CCCN2C(=O)c2cccc(C)c2F)on1 161466696 ONHJDCNSVXGAFJ-ZDUSSCGKSA-N 288.322 3.408 70 20 CGID C[C@@H]1CC[C@H](CC(=O)N[C@@H]2CCOC3(CCCC3)C2)C1 160035959 SLXGXVDORCZXSG-QLFBSQMISA-N 279.424 3.421 70 20 CGID CC[C@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)C1 160111037 LUAXXWBHRJLASZ-AWEZNQCLSA-N 280.456 3.003 70 20 CGID CCO[C@@H](C)C(=O)O[C@@H](C)c1cc(C)ccc1OC 160213243 XIDQHOMRTCHSLV-RYUDHWBXSA-N 266.337 3.033 70 20 CGID CCCCO[C@@H](C)C(=O)OCc1nc(C)sc1C 160761586 NSDUEMOPOZFUHG-VIFPVBQESA-N 271.382 3.008 70 20 CGID O=C(Nc1cccc(F)n1)C1(Cc2ccccc2)CC1 160889684 GBWXICQVFNPHHE-UHFFFAOYSA-N 270.307 3.182 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]2C2CC2)n1 160998080 PTNIZIJGQWWNGA-QWHCGFSZSA-N 296.374 3.019 70 20 CGID Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](C)[C@@H]1CCOC1 159836678 GMDYPGQBVSVFAT-XJKSGUPXSA-N 299.418 3.004 70 20 CGID COc1cc2c(cc1CNC1(C)CCC1)O[C@@H](C)C2 159928005 YMJJQCQGSDBXQN-NSHDSACASA-N 261.365 3.051 70 20 CGID COc1cc(C)ccc1[C@H](C)NCC1(CO)CCCC1 160092667 SXAYKRPMPPOWTL-AWEZNQCLSA-N 277.408 3.207 70 20 CGID Cc1c([C@H](C)NCc2cc(F)cc(Cl)c2)cnn1C 160890207 QZGQMBUECJDAKU-VIFPVBQESA-N 281.762 3.372 70 20 CGID CC(C)N1CC[C@H](CNCc2coc3ccccc23)C1 161095681 IXPOATPZVXTTQR-CQSZACIVSA-N 272.392 3.253 70 20 CGID CC(C)c1ccccc1OS(=O)(=O)C[C@@H]1CCCCO1 216882364 VONWXWFCUYJNKG-ZDUSSCGKSA-N 298.404 3.088 70 20 CGID O=C(NCCCN1CCCCC1)NCCC1=CCCCC1 217445084 BKGUBAFBAMJNCF-UHFFFAOYSA-N 293.455 3.052 70 20 CGID C[C@@H](Nc1nnc(C(F)(F)F)s1)c1ccccn1 160151569 RDJFWVJHFWNJQE-ZCFIWIBFSA-N 274.271 3.125 70 20 CGID CN(Cc1cccc(Cl)c1)C[C@H](O)Cc1ccccc1 218689138 DKNODIFYNXGCHE-QGZVFWFLSA-N 289.806 3.375 70 20 CGID CC[C@H](C)NC(=O)COc1ccc([C@@H](C)CC)cc1 217341999 KQLQCABYJIISAI-STQMWFEESA-N 263.381 3.494 70 20 CGID O=S(=O)(Cl)CCCOc1ccc2ccccc2c1 100495456 QRDIHUKSRSLHJO-UHFFFAOYSA-N 284.764 3.177 70 20 CGID Cc1cccc(C)c1NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 161064464 PDGOYQYFGGCAJW-GJZGRUSLSA-N 288.391 3.383 70 20 CGID CCCn1nc(C)c(C(=O)Nc2cccc(C(C)=O)c2)c1C 161219241 IEBWJWWTBYRLGD-UHFFFAOYSA-N 299.374 3.365 70 20 CGID Cc1ccccc1CN1CCC([C@@H](O)C(F)(F)F)CC1 161493302 OHDZUEQXDKUUPZ-CQSZACIVSA-N 287.325 3.130 70 20 CGID CCCCC(=O)O[C@H](c1c(C)nn(C)c1C)C(F)(F)F 160104109 DHOREFMIVSNEJO-GFCCVEGCSA-N 292.301 3.374 70 20 CGID CC(C)c1ccc(C(=O)NCCc2cccc(F)c2)cn1 160226686 GWTKMVPWXVMUMM-UHFFFAOYSA-N 286.350 3.317 70 20 CGID CSC[C@@H](CCO)N[C@H](C)c1ccc(OC(C)C)cc1 160323886 WAJUSBUXIMPIAP-UKRRQHHQSA-N 297.464 3.238 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)[C@@H]1CC=CCC1 160873921 NOGKDKDSRLIYBO-NWDGAFQWSA-N 277.389 3.182 70 20 CGID Cc1ccccc1[C@@H](NC(=O)[C@@H](C)N)C1CCC(C)CC1 159686098 QGYNQURWIBDXHI-MAIKSMBNSA-N 288.435 3.326 70 20 CGID O=S(=O)(Cl)Cc1csc(-c2ccc(F)cc2)n1 309801441 QHQGHRAZCWGLDT-UHFFFAOYSA-N 291.756 3.018 70 20 CGID C[C@@H](CNCc1cc(F)cc(F)c1)CN1CCCCC1 160400612 GWJFXZMLAAMFIP-ZDUSSCGKSA-N 282.378 3.176 70 20 CGID CN(C(=O)CN1CC[C@@H]2CCCC[C@@H]21)C1CCCCC1 160552409 JIAJKUALLGYQFO-HOCLYGCPSA-N 278.440 3.042 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1cc(C(F)(F)F)ccn1 161425671 GCLPREGFJGQJGF-JTQLQIEISA-N 276.302 3.309 70 20 CGID COc1ccc(CNC(=O)Nc2cc(Cl)ccn2)cc1 217271420 IQXBATPRGAYOIN-UHFFFAOYSA-N 291.738 3.065 70 20 CGID CC(C)(N)C(=O)Nc1ccc(COCc2ccccc2)cc1 161089591 QLJVQAMWJQALTH-UHFFFAOYSA-N 298.386 3.079 70 20 CGID c1cc2c(cc1[C@@H](N[C@@H]1CCSC1)C1CC1)OCCO2 161123118 JCVOGCJFXKLUSS-CJNGLKHVSA-N 291.416 3.004 70 20 CGID CCC[C@@H](C)CC(=O)Nc1ccc(OC)c(N)c1 161197590 MLEGCXYTYXTLKW-SNVBAGLBSA-N 250.342 3.042 70 20 CGID Cc1ccc(NC(=O)NCc2nc(C(C)C)cs2)cn1 161409362 YQKNPRMZTWCDMY-UHFFFAOYSA-N 290.392 3.292 70 20 CGID COCCC1(C(=O)Nc2nnc(C(C)C)s2)CCCC1 160048197 KWNMYRIHOSOYSJ-UHFFFAOYSA-N 297.424 3.197 70 20 CGID CC1(C)CCCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)CC1 160301740 SFAAEFFJIJQRMS-CABCVRRESA-N 294.439 3.166 70 20 CGID Cc1ccc(CNC(=O)c2ccc(CN(C)C)cc2)s1 160380239 MOYGZRWXWMHFMV-UHFFFAOYSA-N 288.416 3.048 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)c1nc2ccccc2o1 160724523 IRCWKHVJFXHKBY-MEBBXXQBSA-N 258.321 3.227 70 20 CGID Cc1cc(Cn2cnc(C(C)C)cc2=O)c2ccccc2n1 160744393 SVESCDCGCXMZBR-UHFFFAOYSA-N 293.370 3.272 70 20 CGID FC(F)(F)c1cccnc1N1CCC[C@H](c2ccn[nH]2)C1 160798480 FGKNGDIHCUWCDU-JTQLQIEISA-N 296.296 3.208 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccc(C(F)(F)F)cc1 160921792 USVUIJSFKZGGIH-UHFFFAOYSA-N 296.292 3.316 70 20 CGID Cc1ccc(O[C@@H](C)C(=O)NCC2(C3CC3)CC2)cc1 159831086 DGWVNXFKXRUBKO-ZDUSSCGKSA-N 273.376 3.069 70 20 CGID CCn1nccc1CNCc1ccc2cc(OC)ccc2c1 159915794 BTSCLNWYLRSQKT-UHFFFAOYSA-N 295.386 3.355 70 20 CGID Cc1ccccc1NC(=O)N[C@H]1CCOC(C)(C)C1 160654741 XHPFQYOEFXVANA-LBPRGKRZSA-N 262.353 3.074 70 20 CGID C[C@H](NC[C@H](C)N(C)Cc1ccccc1)c1ccco1 160876044 LCEKSWFGMVROKQ-GJZGRUSLSA-N 272.392 3.451 70 20 CGID C[C@H](CC(=O)N1CCCC(C)(C)CC1)C1CCNCC1 161045023 ANTUQRPDVUGGFI-CQSZACIVSA-N 280.456 3.051 70 20 CGID Cc1cc(C)cc(OCCN[C@H](C)c2cnc(C)nc2C)c1 161244695 YZGBCRNIEQUFAD-CQSZACIVSA-N 299.418 3.440 70 20 CGID Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccnc2)cn1 161358282 LYIHGJGBZWDTEC-LBPRGKRZSA-N 270.336 3.010 70 20 CGID c1cc2occc2c(N[C@H]2CCO[C@@H](C3CC3)C2)n1 160322770 SVPZOVFSQFHIKI-SMDDNHRTSA-N 258.321 3.197 70 20 CGID COc1ccc(C)c2c1N(Cc1ccccn1)CCC2 160407116 DPODKLGQHVXXSK-UHFFFAOYSA-N 268.360 3.351 70 20 CGID CCC[C@@H]1SCCN1C(=O)c1cc(C)c(C)o1 160895272 VKSUJZIOACIYLJ-LBPRGKRZSA-N 253.367 3.212 70 20 CGID Cc1[nH]ccc1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159456063 KHBXRVWSGAKNGK-WMLDXEAASA-N 298.386 3.221 70 20 CGID CCCCn1ncc(NC(=O)N2CCCC[C@H]2C)c1C 159725299 CNSODKSXVBRTGS-GFCCVEGCSA-N 278.400 3.398 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccccc1SC 159967306 YNMJAJIKGXHFOM-UHFFFAOYSA-N 296.436 3.329 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cc(F)c(F)c(F)c1 160094962 RIJRMVUQWGXSCQ-QWRGUYRKSA-N 288.357 3.485 70 20 CGID COc1cc(CN2CC[C@H](C)C[C@@H]2C)cc(OC)c1O 217843313 SOYNPRXTWNNQBS-RYUDHWBXSA-N 279.380 3.030 70 20 CGID O=C(Nc1ccc(F)cc1OC(F)F)NC1CC=CC1 161458225 WJDGQQLXCZYFDG-UHFFFAOYSA-N 286.253 3.267 70 20 CGID Cc1ccncc1NC(=O)C(=O)Nc1ccc(C(C)C)cc1 160043974 GTHNILGOLNTFAX-UHFFFAOYSA-N 297.358 3.091 70 20 CGID CCc1nc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)n[nH]1 160291605 IPCOPHYWFSVDKR-VIFPVBQESA-N 298.312 3.237 70 20 CGID Cc1cc(N[C@H]2CCO[C@@H](C3CC3)C2)nc(C(C)C)n1 160375788 VUYDZKHVYJHSLU-UONOGXRCSA-N 275.396 3.278 70 20 CGID O=C(N1CCc2c(F)cccc2C1)C1(c2ccccc2)CC1 160896150 VXAZXIBCEOAEOL-UHFFFAOYSA-N 295.357 3.442 70 20 CGID CC(C)NC(=O)CN[C@H](C)c1ccc(-c2ccccc2)o1 160993961 ONJCYUYVXKMEFD-CYBMUJFWSA-N 286.375 3.122 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)Cc1ccc(O)cc1Cl 159498255 DJXSCBZMUBNEDG-HZMBPMFUSA-N 281.783 3.283 70 20 CGID Cc1cc(C(=O)N[C@H]2CCOC3(CCCC3)C2)c(C)o1 159692180 OGAPIQOWDJHBMT-ZDUSSCGKSA-N 277.364 3.118 70 20 CGID C[C@@H](NC(=O)Nc1ccc2c(c1)CCC2)C1CCC1 159511464 MEZMTWJLPQZHLU-LLVKDONJSA-N 258.365 3.485 70 20 CGID NC1(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2)CCCCC1 159723688 MYLYGCXPLDNEJD-CVEARBPZSA-N 286.419 3.101 70 20 CGID CC[C@H]1CCCCN1C(=O)NCc1cccc(C)c1 217314501 PGKFMSGUZMCZCT-HNNXBMFYSA-N 260.381 3.469 70 20 CGID COc1ccc2c(c1)[C@H](N[C@H]1CCC[C@@H](N(C)C)C1)CC2 161040675 LVJSSZIPJCKBBH-HDMKZQKVSA-N 288.435 3.145 70 20 CGID CSC[C@H](CCO)N[C@H](C)c1cccc(Cl)c1 160282369 ZFVYNGHDKQWETE-MFKMUULPSA-N 273.829 3.105 70 20 CGID Cc1cc(NC(=O)Cc2ccc(O)cc2Cl)ccc1O 160694156 ANQLGOQXJBYLEE-UHFFFAOYSA-N 291.734 3.241 70 20 CGID CC[C@H](NC(=O)C[C@H](C)c1ccncc1)c1ccncc1 160784810 LKFSKDAOEQPGOM-BBRMVZONSA-N 283.375 3.238 70 20 CGID CC[C@H](C)[C@H](C)NC(=O)N1CCC(CCCN(C)C)CC1 160932323 KYWHOEMYZXTCMS-GJZGRUSLSA-N 297.487 3.184 70 20 CGID CC(C)(C)c1nsc(NCC(=O)OC2CCCCC2)n1 159818326 YVQHADWBHKDNJI-UHFFFAOYSA-N 297.424 3.123 70 20 CGID CCC[C@@H](N[C@H](C)c1cccc(F)c1F)C(=O)OCC 159486102 VXOIPEXMPOZAPB-ZWNOBZJWSA-N 285.334 3.347 70 20 CGID CCOCCC1(CNC(=O)NCC2(CC)CCC2)CC1 159549543 DVIHRSYHTONDRK-UHFFFAOYSA-N 282.428 3.073 70 20 CGID CCC[C@H](C)CC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 159550571 YBHCSAABCZXJIO-UXLLHSPISA-N 291.435 3.484 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)C[C@@H]1CCCOC1 159973580 VDDUKZWZULGIJZ-AWEZNQCLSA-N 284.444 3.271 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1ccc(Br)cc1 161397100 ARYPYXYJOQTDMN-NXEZZACHSA-N 282.181 3.462 70 20 CGID CC[C@@H](C)[C@H](C)NC(=O)NCCc1ccc(C)cc1 217224324 NCVLYTCVPISPHG-KGLIPLIRSA-N 262.397 3.271 70 20 CGID COc1ccc([C@@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)c(F)c1 161016336 YQRBXJWLMRNFDO-MCIONIFRSA-N 294.414 3.358 70 20 CGID CCCN1CCC(N(C)C(=O)c2cccc(C)c2F)CC1 161487618 FXOBUSNNBBHIIS-UHFFFAOYSA-N 292.398 3.081 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCCO1)c1cc2ccccc2o1 160194143 KTFOCGFDXHGFCQ-FZMZJTMJSA-N 273.332 3.179 70 20 CGID Cc1ccc(C(=O)NC2CC2)cc1NCc1occc1C 160242297 HGSBTYVJWTXQIU-UHFFFAOYSA-N 284.359 3.401 70 20 CGID Cc1cc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3C3CC3)cc2)n[nH]1 160474416 OCOPQYPGCLTVIJ-CABCVRRESA-N 297.358 3.495 70 20 CGID CC/C=C(/C)C(=O)N[C@@H](C)CC(=O)c1cccs1 160706305 KZMYTQQIGCYBJI-YAEJEKNGSA-N 265.378 3.182 70 20 CGID Cc1ncc([C@H](C)NCc2ccc(C)s2)c(C)n1 160920617 BBOFMLSVXWXNCG-JTQLQIEISA-N 261.394 3.314 70 20 CGID COc1cc(C)ccc1NC(=O)NC1C[C@H](C)O[C@@H](C)C1 159801903 RGNYRJOSGBJHHO-RYUDHWBXSA-N 292.379 3.081 70 20 CGID CC[C@H](NC(=O)[C@H]1CCC[C@H](N)C1)c1ccc(F)cc1F 159727394 AYVLEHFBMSYGIZ-WBIUFABUSA-N 296.361 3.050 70 20 CGID Cc1ncncc1C(=O)N1C[C@H](C)CSc2ccccc21 159590422 MOUIRGNOWRMGJA-NSHDSACASA-N 299.399 3.174 70 20 CGID Fc1cccc(NC2CCN(c3ccccc3)CC2)n1 218123221 UXFQAYZCWDWEJH-UHFFFAOYSA-N 271.339 3.302 70 20 CGID CC[C@@H](CC1CCCC1)C(=O)N[C@H](CO)CC(C)C 161079822 HLTRMHFTTNROQK-GJZGRUSLSA-N 269.429 3.116 70 20 CGID CSc1ccc(NC(=O)N[C@H]2CCOC(C)(C)C2)cc1 161402873 WGCLOQQPYMCURG-LBPRGKRZSA-N 294.420 3.488 70 20 CGID Cc1ccc(CNC(=O)[C@H](C)Sc2ccncc2)cc1 160033760 QEINRHUGVUYDJL-ZDUSSCGKSA-N 286.400 3.187 70 20 CGID Cc1ccc(NC(=O)c2cnn(CC(C)C)c2C)c(O)c1 160149606 RWWWQXNFTKAKQD-UHFFFAOYSA-N 287.363 3.114 70 20 CGID CC1CCC(N(C)C(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)CC1 160505605 RIEDYSPEGRQWBD-IGDQZBHYSA-N 294.439 3.164 70 20 CGID C[C@@H]1C[C@H](N(C)C(=O)C2CCC(C)(C)CC2)CCN1C 160658254 MUSNNEZPNJRIOZ-UKRRQHHQSA-N 280.456 3.144 70 20 CGID CC(C)[C@@H](NCc1nnc2n1CCCCC2)c1ccccc1 160718428 SDQHCJFGVXDDEJ-GOSISDBHSA-N 298.434 3.491 70 20 CGID CCc1nc2c(s1)[C@@H](N(C)C(=O)C(C)C)CCC2 160987362 XJTRUCXECJQHHG-NSHDSACASA-N 266.410 3.197 70 20 CGID C[C@H](c1c(F)cccc1F)N(C)CCOCC1CC1 159647278 KBFCXBMUSLHGOZ-LLVKDONJSA-N 269.335 3.384 70 20 CGID CC[C@@H](OC1CCCC1)C(=O)NCC1(C2CC2)CC1 159876040 RZSHBWGCLNJLQI-CQSZACIVSA-N 265.397 3.031 70 20 CGID CC(C)CSc1nnc(COc2ccccc2)n1C 159389160 CVHPHUAMGMOQIL-UHFFFAOYSA-N 277.393 3.142 70 20 CGID CC(C)N1CC[C@@H](CNCc2coc3ccccc23)C1 161095812 IXPOATPZVXTTQR-AWEZNQCLSA-N 272.392 3.253 70 20 CGID CCNC(=S)Nc1cc(F)c(Br)cc1C 160981705 VASHGQXWRJXMPR-UHFFFAOYSA-N 291.189 3.203 70 20 CGID CC(C)(C)CCOCCCCCS(=O)(=O)Cl 116968309 HNMQUAZARVBNGL-UHFFFAOYSA-N 270.822 3.178 70 20 CGID CCC[C@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccccc1 216663963 ZBTXBJZXSBJNED-UONOGXRCSA-N 279.380 3.413 70 20 CGID CC(C)(C)OC(=O)NCc1ccccc1CNCC1CC1 218179672 DCUVAVDSNSDRCE-UHFFFAOYSA-N 290.407 3.211 70 20 CGID Clc1cc(N[C@H]2CCN3CCCC[C@@H]23)nc(C2CC2)n1 217455779 FPQMQVIUYGKRGX-RYUDHWBXSA-N 292.814 3.046 70 20 CGID COCCC1(CNC(=O)N(C2CC2)[C@@H](C)C(C)C)CC1 161112167 MADAEKYKLUVEBH-ZDUSSCGKSA-N 282.428 3.022 70 20 CGID COCC(C)(C)C(=O)NCC1(c2ccccc2)CCCC1 161202094 BGDFUWMPZCUMBF-UHFFFAOYSA-N 289.419 3.287 70 20 CGID CCCN(CCO)Cc1ccc(OC)c(O[C@H](C)CC)c1 161202539 CVECJWWLDXNOQZ-CQSZACIVSA-N 295.423 3.077 70 20 CGID CC1(C)C[C@H](NCc2cnc(C3CCC3)s2)CCO1 160504143 DXDJIULNVSXHCO-GFCCVEGCSA-N 280.437 3.458 70 20 CGID CCc1cc(O)nc(CN[C@@H](C)c2ccccc2Cl)n1 160539169 QHQNZXGFWYRHKA-JTQLQIEISA-N 291.782 3.249 70 20 CGID COc1c(F)cc(NC(=O)C[C@H](C)SC)cc1F 160603789 OSBHVZWMFUXNHC-ZETCQYMHSA-N 275.320 3.054 70 20 CGID C[C@@H](CC(=O)N(C)C)c1ccccc1C(F)(F)F 159817329 HSSGVJNQPZRLRT-VIFPVBQESA-N 259.271 3.287 70 20 CGID CC(C)(C)c1nsc(NC[C@@]2(C)CCCC[C@@H]2O)n1 159828653 XNATVMXFSZSYGI-IINYFYTJSA-N 283.441 3.189 70 20 CGID CCc1ccccc1NC(=O)N(C)[C@H]1CCSC1 159521563 RLWRFQKQAJWIGM-LBPRGKRZSA-N 264.394 3.218 70 20 CGID CNc1ccc(C(F)(F)F)cc1C(=O)NC[C@H]1C[C@@H]1C 160090095 GWTGQGMQTMMMAU-DTWKUNHWSA-N 286.297 3.133 70 20 CGID CN(Cc1ccc(CO)o1)Cc1ccccc1Cl 160820301 CLSGBRVJPYNMGN-UHFFFAOYSA-N 265.740 3.057 70 20 CGID C[C@@H](CC(C)(C)c1ccccc1)S(=O)(=O)Cl 103915932 NUIHPTPOTQYLDK-JTQLQIEISA-N 260.786 3.311 70 20 CGID C[C@@H](C(=O)N(C)Cc1cccnc1)c1c(F)cccc1F 161061452 IGEBLINQTMIYHI-LLVKDONJSA-N 290.313 3.122 70 20 CGID Cc1ccc([C@H](C)N(C)C(=O)[C@H]2CCCCO2)cc1 161118382 BJDFCLZJEQJLMX-DZGCQCFKSA-N 261.365 3.084 70 20 CGID c1ccc2c(c1)CC[C@H]2NCCc1ccc2c(c1)OCO2 161119870 CBYCWMVOVWGACX-MRXNPFEDSA-N 281.355 3.235 70 20 CGID CCC[C@H](CC)NC(=O)N1CCC(CCCN(C)C)CC1 161252483 CHAJRUWVQRVWIL-INIZCTEOSA-N 297.487 3.329 70 20 CGID Cc1cc2cc(C(=O)N[C@H]3CCC[C@H](N)C3)oc2cc1C 161447607 ZXNLHVKIXXBZPE-KBPBESRZSA-N 286.375 3.049 70 20 CGID CC(C)CC[C@H](C)NC[C@@](C)(O)c1ccsc1 160044576 VZNINDIATOILJZ-GXTWGEPZSA-N 255.427 3.370 70 20 CGID CC(C)Oc1ccc(CN[C@H](C(C)C)C2CC2)cn1 160101792 FVQFGOILZUWLOT-MRXNPFEDSA-N 262.397 3.393 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](C)C2CCCC2)c1 160632432 HMYXBJOTDBMGRW-AWEZNQCLSA-N 288.435 3.495 70 20 CGID CCCC1(CNC(=O)c2ccc(-c3nnc(C)[nH]3)cc2)CC1 160743359 CEZIMNREYUIZLE-UHFFFAOYSA-N 298.390 3.090 70 20 CGID O=C(Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCCO1 159413403 JRVBOUGIZZRXRK-LLVKDONJSA-N 289.253 3.093 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)[C@H]2CCCCO2)C1 159640136 YIOZERAKDKZZQL-TZMCWYRMSA-N 291.416 3.331 70 20 CGID Cc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCCSC1 159534964 FTBGFDKLEPDRFT-UONOGXRCSA-N 292.448 3.197 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N1CCC[C@@H]1c1ccccc1 159541818 PWFMAUAAMDKFHD-IAOVAPTHSA-N 285.387 3.355 70 20 CGID CCCN(CCCS(=O)(=O)C(C)C)Cc1ccccc1 160520226 QKYGFFCYMRXZQJ-UHFFFAOYSA-N 297.464 3.112 70 20 CGID Cc1ccc(CCNC(=O)Nc2cccc(F)c2)cc1 217307892 LZOPBIXZLLJXAS-UHFFFAOYSA-N 272.323 3.498 70 20 CGID Cc1ncccc1NC(=O)C(=O)Nc1ccc(C(C)C)cc1 160024860 KLZOGORIHJQKNN-UHFFFAOYSA-N 297.358 3.091 70 20 CGID CCCn1nccc1CN[C@@H](C)CCc1ccc(O)cc1 160082128 YTIPJIXSPHXGCT-AWEZNQCLSA-N 287.407 3.110 70 20 CGID FC(F)(F)c1ccnc(N[C@@H]2CCO[C@H](C3CC3)C2)c1 160332381 AISKDABCEULTFS-NEPJUHHUSA-N 286.297 3.470 70 20 CGID CCCOc1cccc(CC(=O)N(C)Cc2cccnc2)c1 160543457 MAFBYSZBMJVTKB-UHFFFAOYSA-N 298.386 3.072 70 20 CGID CCCn1ccc2ccc(NC(=O)CC3CCNCC3)cc21 159852946 MQZVPFNSCOUKKV-UHFFFAOYSA-N 299.418 3.380 70 20 CGID CN(C(=O)Nc1ccc2c(c1)CCC2)[C@@H]1CCSC1 159509545 XKBVRYPYMBZKOV-CQSZACIVSA-N 276.405 3.145 70 20 CGID C[C@@H]1CC[C@@H](C(=O)Nc2cc(C(C)(C)C)ccc2O)O1 159571726 JEUNTWXOUYELGN-YGRLFVJLSA-N 277.364 3.196 70 20 CGID C[C@H](CCC(C)(C)C)NC(=O)[C@H](N)c1ccccc1 161230401 JZRLBZQNGZUOBV-TZMCWYRMSA-N 262.397 3.017 70 20 CGID CCOc1ccccc1NC(=O)N1[C@H]2C=CC[C@H]1CC2 218753668 TYSKLMKBDAWBSR-STQMWFEESA-N 272.348 3.410 70 20 CGID FC(F)(F)c1cccc(CN[C@H]2CCN3CCCC[C@@H]23)c1 217644019 IZDOPOAWVGNWJP-GJZGRUSLSA-N 298.352 3.422 70 20 CGID CCCN(CC)CCN[C@@H]1CCCc2ccc(O)cc21 217667178 LVOMQGVXOSQHNP-QGZVFWFLSA-N 276.424 3.091 70 20 CGID CCC(CC)(CN)C(=O)N[C@@H]1CCC[C@@H](C(C)C)C1 161213772 ZGTPINZJQOUBGT-ZIAGYGMSSA-N 268.445 3.083 70 20 CGID Cc1cccc(C(=O)Nc2cccc(CN(C)C)c2)c1F 161451109 DZUNLYVSKBCJTC-UHFFFAOYSA-N 286.350 3.448 70 20 CGID COC[C@@H](NC(=O)Nc1ccc2[nH]c(C)cc2c1)C1CC1 160069568 QYVMZHLSVNFZSJ-OAHLLOKOSA-N 287.363 3.023 70 20 CGID CC(C)n1cc([C@H](C)NCCCN2CCCC[C@@H]2C)cn1 160280251 SBUXWDPIUFTGNO-HOTGVXAUSA-N 292.471 3.379 70 20 CGID CSC[C@H](CCO)N[C@@H](C)c1ccc2c(c1)CCCC2 160367113 LVKNOJHVTZAOLE-GUYCJALGSA-N 293.476 3.330 70 20 CGID CCCN(C)c1ccc(C(=O)N(C)Cc2cccn2C)cc1 160554534 RKXYHHIXAMYYPX-UHFFFAOYSA-N 299.418 3.144 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccccc1 160700536 PNZUIEGRHFXSBG-NSHDSACASA-N 273.357 3.139 70 20 CGID CCCCn1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c1C 160932573 HZNZRKAJDLQOFU-BETUJISGSA-N 277.412 3.110 70 20 CGID c1ccc2c(c1)OCCC[C@@H]2N[C@H]1CCCSC1 159608967 ZTPLCCXOAMJPNP-JSGCOSHPSA-N 263.406 3.386 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)s1 159529551 PBOIGKWAGNUVPA-LBPRGKRZSA-N 279.405 3.278 70 20 CGID CCCCn1ncc(NC(=O)N2CC[C@@H](C)[C@@H]2C)c1C 159937442 LTZBMMSSZFBBKX-NEPJUHHUSA-N 278.400 3.254 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)CSCc1ccccn1 159759710 FQFJPKFFPXNULT-GXTWGEPZSA-N 278.421 3.010 70 20 CGID CCc1c[nH]c(Sc2nc(C(C)(C)C)ns2)n1 159985032 FFVQNEURCJGCFC-UHFFFAOYSA-N 268.411 3.272 70 20 CGID CCOc1ccccc1CN[C@@H]1CCOC(C)(C)C1 160442849 CFVPTTRRYYTILW-CQSZACIVSA-N 263.381 3.133 70 20 CGID C[C@@H](CNCc1coc2ccccc12)N1CCCCC1 161094863 FWJKNZQSIDVQKS-AWEZNQCLSA-N 272.392 3.397 70 20 CGID O=S(=O)(Cl)c1cc(F)ccc1-c1ccccc1 112734371 JGZVWMRVJMIDLF-UHFFFAOYSA-N 270.712 3.420 70 20 CGID CCCNC(=O)Nc1cccc(OCc2nccs2)c1 161311991 FYVGVQLYVIVCQX-UHFFFAOYSA-N 291.376 3.254 70 20 CGID CC(=O)NC1CCC(Nc2ccc3c(c2)CCC3)CC1 161327647 PPPOONWJVAGKQF-UHFFFAOYSA-N 272.392 3.035 70 20 CGID CCc1ccc(/C=C/C(=O)Nc2c(C)noc2CC)o1 161422868 KWWCQWCGOJJUFH-CMDGGOBGSA-N 274.320 3.353 70 20 CGID CCCCO[C@@H](C)C(=O)N1CCc2c(Cl)cccc21 161458824 IBWXAOVPNRCKKM-NSHDSACASA-N 281.783 3.434 70 20 CGID Cc1ccc(NC(=O)C(C)(C)N)cc1OCCC(C)C 161509434 ZWNKKONCMSKQCK-UHFFFAOYSA-N 278.396 3.096 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCCc1nc2ccccc2s1 160146767 LVJCTSCIXARCHD-ZBEGNZNMSA-N 288.416 3.391 70 20 CGID CC(C)(C)c1ccc(S(=O)(=O)Nc2ccccn2)s1 160349508 VTVIVAKZXCPDFJ-UHFFFAOYSA-N 296.417 3.241 70 20 CGID OCc1ccccc1CNc1nc(C(F)(F)F)cs1 160420382 FFLLHDWHPSNFFF-UHFFFAOYSA-N 288.294 3.266 70 20 CGID Cc1cc(NC(=O)[C@@H]2CC2(C)C)n(Cc2ccccc2)n1 160534179 VYWIZOQZKOYHOK-AWEZNQCLSA-N 283.375 3.224 70 20 CGID CC[C@H](Nc1ccn(CCOC)n1)c1ccc(F)cc1F 160927107 AJUFVKMJHVNBTF-AWEZNQCLSA-N 295.333 3.371 70 20 CGID O=C(CCOc1ccccc1Cl)NCC1(C2CC2)CC1 159820789 IKDXAWXJVFBASY-UHFFFAOYSA-N 293.794 3.415 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)NCCc1cscn1 159444104 NMYQCEBHCMWOJQ-TZMCWYRMSA-N 295.452 3.296 70 20 CGID Cc1nccc(NC(=O)NCCCCOC(C)C)c1Cl 159681955 YFRKUVATFXPVCC-UHFFFAOYSA-N 299.802 3.370 70 20 CGID NC1(C(=O)N[C@H]2CCC[C@H]2c2ccccc2)CCCCC1 159723552 MYLYGCXPLDNEJD-HOTGVXAUSA-N 286.419 3.101 70 20 CGID CCC[C@](C)(NC(=O)c1ccc(Cl)cc1C)C(=O)OC 160746356 OBPXUTKHPXCRTQ-HNNXBMFYSA-N 297.782 3.110 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cccc(F)c1 161111339 LWCZMMHXEYBBES-MAZHCROVSA-N 264.388 3.349 70 20 CGID O=C(c1cc(-c2cccs2)[nH]n1)N1[C@H]2C=CC[C@H]1CC2 218742649 NRYPHRYEHRAAFO-QWRGUYRKSA-N 285.372 3.071 70 20 CGID O=C(CCc1ccccc1F)N1[C@H]2C=CC[C@H]1CC2 218715311 XUWFSAPKZQZDCS-KBPBESRZSA-N 259.324 3.078 70 20 CGID CC(C)CC[C@H](C)NC(=O)NCCc1ccc(F)cc1 218052518 UVOZUINJXQLYAR-ZDUSSCGKSA-N 280.387 3.492 70 20 CGID CC(C)N(Cc1ccc(CO)o1)C1CCCCC1 159770020 MBKQWKFZIBDYQF-UHFFFAOYSA-N 251.370 3.315 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@]2(C)CC)n1 161024176 HJNGKCOFPMYWRT-PXAZEXFGSA-N 298.390 3.409 70 20 CGID C[C@@H]1CN(C(=O)Nc2cc(C(C)(C)C)on2)CC[C@H]1C 161084629 HGDLSDRFZSYQOF-GHMZBOCLSA-N 279.384 3.482 70 20 CGID C[C@H](NC(=O)N1CCc2c(F)cccc2C1)c1cccnc1 161185936 XEKVIKVKBRNRCC-LBPRGKRZSA-N 299.349 3.050 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)C2CCCC2)o1 161244301 RPTPGKPRJBHQCE-AWEZNQCLSA-N 277.364 3.280 70 20 CGID CCc1noc(C)c1CN1CCN(C)C[C@@H]1c1ccccc1 161341147 WDLZKJYEUMBKNE-GOSISDBHSA-N 299.418 3.034 70 20 CGID CCC[C@@H]1CCCN(C(=O)C[C@H](C)C2CCNCC2)C1 161447683 REJBWALWJCFWFB-LSDHHAIUSA-N 280.456 3.051 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cc2ccccc2n1C 161458259 PKNNLMAOPLKUNE-RYUDHWBXSA-N 256.349 3.191 70 20 CGID O=C(CC[C@H]1CCOC1)N[C@@H]1CCCc2sccc21 160092347 CFQPPKFXVONPCX-WCQYABFASA-N 279.405 3.058 70 20 CGID CNC(=O)c1ccc(NC(=O)C2CCCCC2)c(Cl)c1 160284748 NSCPKHPGLJHHLY-UHFFFAOYSA-N 294.782 3.218 70 20 CGID CC[C@H](C)[C@@H](C)NC(=O)Nc1ccn(CC(F)(F)F)n1 160570964 PNIYUDYGXLNXRW-DTWKUNHWSA-N 292.305 3.002 70 20 CGID Cc1noc(C)c1C[S@](=O)c1ncc(C(C)(C)C)s1 160602183 AJLYBZSCYLIDPW-LJQANCHMSA-N 298.433 3.353 70 20 CGID CC[C@H](C)OCC(=O)N[C@@H]1CCC(C)(C)C[C@@H]1C 160810226 RHOSLUKRDCWYGS-RWMBFGLXSA-N 255.402 3.133 70 20 CGID CCCC1(CNC(=O)c2ccc(-c3nnc(C)o3)cc2)CC1 160691253 ACUUVDYLAWFJRT-UHFFFAOYSA-N 299.374 3.355 70 20 CGID O=C(NCCc1cc2ccccc2[nH]1)NCC1(C2CC2)CC1 160807836 YAPZPWTZYSMODK-UHFFFAOYSA-N 297.402 3.200 70 20 CGID CC(C)C[C@@H]1CCCCN1C(=O)C[C@H](C)[C@@H]1CCCNC1 160875206 ZEYOFDRMHQTHPY-BBWFWOEESA-N 294.483 3.439 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc(Cl)o1 159414364 RSLCLAWLLYGHTL-JTQLQIEISA-N 283.755 3.155 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](COC)C(C)C)C1 159433488 YAOSTAGEFVCFLH-MJBXVCDLSA-N 259.459 3.311 70 20 CGID CSc1cc(C)ccc1CNC(=O)C(C)(C)F 159681505 JIRKVJBMGLNMPM-UHFFFAOYSA-N 255.358 3.081 70 20 CGID CC1(C)C[C@H]1C(=O)NCCCCOCCc1ccccc1 159371087 WLAGSXDNJUHDQQ-INIZCTEOSA-N 289.419 3.188 70 20 CGID CCOCCCN(C)Cc1ccc(SC)c(OC)c1 159815345 CRUSHACFHQGACS-UHFFFAOYSA-N 283.437 3.276 70 20 CGID CC[C@H](C)[C@@](C)(O)CNC(=O)CC[C@@H](C)c1ccccc1 161060619 KSHIWZLUIQTOJA-VKJFTORMSA-N 291.435 3.484 70 20 CGID C1CCC(CCCSCc2nnnn2C2CC2)C1 161210585 QFDREQPLZHAEOE-UHFFFAOYSA-N 266.414 3.212 70 20 CGID Cc1nc(C2(NCc3cc(F)ccc3F)CCCC2)no1 161379210 MVGIXZRAUKWFAO-UHFFFAOYSA-N 293.317 3.215 70 20 CGID CC(C)Oc1cccc(CC(=O)Nc2cccc(F)n2)c1 160751921 PDHQFUFRZCQPDW-UHFFFAOYSA-N 288.322 3.189 70 20 CGID CC[C@H](NC(=O)NC1(C)CCC1)c1nc(C)cs1 160852896 LPUVQUISMBDYIE-JTQLQIEISA-N 267.398 3.144 70 20 CGID CCc1noc([C@H](C)N[C@H](C)c2cccc(F)c2F)n1 159513876 NYVJNDLOVBVMPD-BDAKNGLRSA-N 281.306 3.322 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(-c2cccnc2)on1 159592227 XMTDKIXEHHPZHW-WCQYABFASA-N 285.347 3.045 70 20 CGID c1ccc2c(CNC[C@H]3CCN(C4CC4)C3)coc2c1 159817897 VFKIBPZBDJPGGF-CYBMUJFWSA-N 270.376 3.007 70 20 CGID OC[C@@H](NCc1coc2ccccc12)c1ccccc1 161103155 KNMGKSLEFLCJFL-MRXNPFEDSA-N 267.328 3.256 70 20 CGID CC[C@@H](C)N(CCCCS(C)(=O)=O)Cc1ccccc1 161224156 MYJJHBKOOZRUIN-OAHLLOKOSA-N 297.464 3.112 70 20 CGID COc1cccc(-c2noc([C@H]3CCC(=O)C[C@@H]3C)n2)c1 161013933 LFWBHBLRYZCUMJ-HZMBPMFUSA-N 286.331 3.218 70 20 CGID CC[C@H](C)NC(=O)c1cccc(CN[C@@H](C)C(C)C)c1 161067100 NFFNWOZCWADXCV-KBPBESRZSA-N 276.424 3.349 70 20 CGID Cc1cc(C(=O)Nc2cccc(C(C)C)c2)ncn1 161251125 XLPHHJVKNJTYRL-UHFFFAOYSA-N 255.321 3.161 70 20 CGID CC(C)C1CCN(C(=O)[C@H]2CCCCCC[C@H]2N)CC1 161269693 QRWVKLUXSQTXCL-JKSUJKDBSA-N 280.456 3.179 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1nc2cc(F)ccc2o1 161438066 WPGDEVMJVJFLIJ-JTQLQIEISA-N 266.316 3.176 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@@H]2C=CCCC2)n1 160326566 HAEDUVGSQOXVQG-CYBMUJFWSA-N 276.384 3.159 70 20 CGID C[C@@H](Cc1ccccc1F)C(=O)N(C)Cc1cccn1C 160655322 MUBCBQCDRBANHN-ZDUSSCGKSA-N 288.366 3.001 70 20 CGID CC(C)C[C@H](CO)NC(=O)c1ccc(OC(C)(C)C)cc1 160802188 RTKHIUMTWFSBLO-CQSZACIVSA-N 293.407 3.001 70 20 CGID CS[C@@H](C)CC(=O)NC[C@H](C)COCc1ccccc1 160903722 OIGOJJQPWSCSNQ-KBPBESRZSA-N 295.448 3.097 70 20 CGID C[C@@H](NC(=O)c1ccc(CN)cc1)[C@H](C)c1ccccc1 160891776 DOSNZMNVYZZPQH-UONOGXRCSA-N 282.387 3.067 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H](COC)C(C)C)C1 159433864 YAOSTAGEFVCFLH-RDBSUJKOSA-N 259.459 3.311 70 20 CGID CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NCC2CC2)c1 159642369 IIALNFKEOIZTSY-UHFFFAOYSA-N 294.782 3.074 70 20 CGID NCc1ccc(C(=O)N[C@H]2CCC[C@H]2c2ccccc2)cc1 159718828 VSWMBTYMIZHLRI-ROUUACIJSA-N 294.398 3.211 70 20 CGID CCC(C)(CC)C(=O)N[C@H]1CC(C)(C)OC1(C)C 159529102 SDFVJISJJKGCCG-NSHDSACASA-N 255.402 3.275 70 20 CGID CCOc1ccc([C@H](C)N[C@H](C)[C@@H]2CCOC2)cc1OC 159946296 CBCAGXTXMOBTMI-GZBFAFLISA-N 293.407 3.170 70 20 CGID CC(C)(CO)CN[C@@H]1CCCc2c1[nH]c1ccccc21 160126601 ULIZRFAKRAIKJY-OAHLLOKOSA-N 272.392 3.153 70 20 CGID Cc1ccccc1OCCCNC(=O)N1CCCC[C@@H]1C 217300384 KELYKQRNNMSXNB-HNNXBMFYSA-N 290.407 3.348 70 20 CGID CC(=O)Nc1cccc(NC(=O)N(C)c2ccccc2)c1 217300608 FDZNRDXRIOJETK-UHFFFAOYSA-N 283.331 3.313 70 20 CGID C[C@H]1CCCC[C@@H]1NC(=O)c1ccnc(Cl)c1F 160881624 YESIMVGPCYTPRH-WPRPVWTQSA-N 270.735 3.183 70 20 CGID CC(C)CC(=O)N(Cc1ccccc1)CC1(O)CCCC1 161205973 LPSGJIVEUGGUNW-UHFFFAOYSA-N 289.419 3.366 70 20 CGID COc1ccc(NC(=O)C[C@H](C)CC(C)C)cc1N 161284088 XJHVQRFVJBSHMO-LLVKDONJSA-N 264.369 3.288 70 20 CGID C[C@@H]1OCCN(C(=O)CCC(C)(C)c2ccccc2)[C@H]1C 160046737 QFMMCESFLKQYSS-GJZGRUSLSA-N 289.419 3.380 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)NC[C@@H](C)c1c(C)noc1C 160231560 HKLGIRBYPDSSTJ-SWHYSGLUSA-N 293.411 3.273 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(C)cc1F)[C@@H]1CCCO1 159439551 JRKHHEJDHKZUOF-OCCSQVGLSA-N 280.343 3.213 70 20 CGID CCC[C@H]1CN(C(=O)[C@H](c2ccccc2)C2CC2)CCO1 159461313 QPLLGIDKODOQRE-DLBZAZTESA-N 287.403 3.208 70 20 CGID CC1=CCN(C(=O)c2cc3ccccc3cc2O)CC1 160228014 QXIFWHRNDXGSLK-UHFFFAOYSA-N 267.328 3.338 70 20 CGID CCC(CC)(CNC(=O)N1CCC(C)CC1)SC 218004063 MKKAEPQNUTXGKA-UHFFFAOYSA-N 272.458 3.350 70 20 CGID CN(Cc1ccccc1)CC(C)(C)NCc1cccn1C 159394321 GVUKNMSJEZUFGD-UHFFFAOYSA-N 285.435 3.025 70 20 CGID CCC[C@@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cl 88251367 WTSVRIQHTAXBNY-JTQLQIEISA-N 277.729 3.005 70 20 CGID CC(C)CCN(C)C(=O)Nc1ccn(CCC(C)C)n1 161070315 HOORBIIJDKGUTC-UHFFFAOYSA-N 280.416 3.439 70 20 CGID CCOc1cc(NC(=O)N[C@H](C)C2CCC2)ccc1OC 161285359 DXFUAOFEWDQMGV-LLVKDONJSA-N 292.379 3.404 70 20 CGID CCCCN(CCCC)C(=O)c1cnc2c(c1)ncn2C 160113320 FQOHBSIWNMQHDW-UHFFFAOYSA-N 288.395 3.011 70 20 CGID CC(C)=C[C@@H]1[C@H](C(=O)NCCc2cccc(O)c2)C1(C)C 160217698 QYOAVNWRFSCMPO-HZPDHXFCSA-N 287.403 3.289 70 20 CGID CC[C@@H](NCCCN1CCCC1=O)c1ccc(F)cc1F 159531867 OTUBCPOFEGBUEI-OAHLLOKOSA-N 296.361 3.018 70 20 CGID COc1cccc([C@H](C)NC[C@H]2CCC(C)(C)O2)c1 160325324 JDAFLXKXSUYLKJ-SWLSCSKDSA-N 263.381 3.303 70 20 CGID Cc1nccn1CCCCN(C)CCc1ccccc1 161422376 LWMYJIUCSDIIIZ-UHFFFAOYSA-N 271.408 3.146 70 20 CGID CCc1ccc([C@H](C)N[C@H]2CCC[C@H](N(C)C)C2)o1 161141746 VOKWHUBYCHUZIT-IHRRRGAJSA-N 264.413 3.365 70 20 CGID O=C([C@@H]1CCCO1)N1C[C@H]2CCCC[C@@]21c1ccccc1 161302103 SBVUBWVFAHJNAV-SOLBZPMBSA-N 285.387 3.093 70 20 CGID CCOC(=O)C1CCC(NC(=O)[C@@H]2CCC[C@@H](C)C2)CC1 161347469 FSYBVMJXEALUJO-FEWQNLEASA-N 295.423 3.051 70 20 CGID Cc1cnccc1CCNC(=O)N[C@@H](C)CCC(C)(C)C 161380995 UWUGOUBDSSPTCG-AWEZNQCLSA-N 291.439 3.447 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)CCOc1ccccc1F 160236378 TVSCYIWCUOFZBI-MLGOLLRUSA-N 279.355 3.099 70 20 CGID CCCC1(CNC(=O)NC[C@H](C)SC)CCC1 160300914 PTYRFSRIVZTJJB-NSHDSACASA-N 258.431 3.008 70 20 CGID CC(C)CCOc1ccc(NC(=O)C[C@H]2CCCN2)cc1 160307955 NRKGPHSAYZIGNO-OAHLLOKOSA-N 290.407 3.192 70 20 CGID CS[C@@H](C)CC(=O)N[C@@H](C)Cc1ccccc1C 160324943 ONRAXUINGGBWJV-STQMWFEESA-N 265.422 3.184 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cccc(Nc2cnn(C)c2)c1 160407925 CFCUHEHLSLBKQN-CHWSQXEVSA-N 298.390 3.177 70 20 CGID CC[C@H](C)[C@@H](C)NCc1ccccc1CN1CCOCC1 160427965 ATXFYZGWUQLBEJ-JKSUJKDBSA-N 290.451 3.043 70 20 CGID CCc1cccc(NC(=O)N(C)[C@H]2CCSC2)c1 159458393 MBWVCYCDQYFRBN-ZDUSSCGKSA-N 264.394 3.218 70 20 CGID CCOC(C)(C)CNC(=O)c1cc2ccccc2cc1O 159488023 MOCWIIWXARECKO-UHFFFAOYSA-N 287.359 3.090 70 20 CGID O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCCS1 159932933 OQQZWNCGTWTXEW-ZJUUUORDSA-N 291.294 3.124 70 20 CGID CC[C@@H](COC)NC(=O)NC1(c2ccccc2)CCCC1 159953607 RYAFKPRUWLJEMM-HNNXBMFYSA-N 290.407 3.180 70 20 CGID Nc1ccccc1Cc1nc([C@H]2CCCCS2)no1 160655351 AYOQFGFWKWMOCX-GFCCVEGCSA-N 275.377 3.201 70 20 CGID Cc1cccc(CCNC(=O)NCc2cccc(F)c2)c1 217314811 AHUFVSOBWKIIND-UHFFFAOYSA-N 286.350 3.176 70 20 CGID CCc1nc2c(s1)[C@@H](N(C)C(=O)c1cc[nH]c1)CCC2 161007919 XPWIAMSWUVEZHK-LBPRGKRZSA-N 289.404 3.183 70 20 CGID COc1ccc(C(=O)N2CCC[C@@H](CC(C)C)C2)c(O)c1 161192202 FGINJXUDLKRDFB-ZDUSSCGKSA-N 291.391 3.299 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)c3occc3C)c2C)o1 161363860 NWVFEVARFCVZQA-UHFFFAOYSA-N 285.303 3.440 70 20 CGID C[C@@H](Cc1ccco1)Nc1nnc(C(F)(F)F)s1 160156195 PDFPBRSXKVKINF-LURJTMIESA-N 277.271 3.193 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160331479 AOKQTGMVPDEYIF-GJZGRUSLSA-N 297.439 3.190 70 20 CGID CC[C@H](SC)C(=O)N[C@@H](CC)c1c(C)noc1C 160575984 PJPBQVMQBKRPRJ-QWRGUYRKSA-N 270.398 3.000 70 20 CGID CCSc1cccc(C(=O)Nc2ccc3[nH]nnc3c2)c1 160955720 QRAJMWVBBQNVIV-UHFFFAOYSA-N 298.371 3.322 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 159804674 HRQMENLZFSXATB-WMLDXEAASA-N 286.375 3.188 70 20 CGID O=C(Nc1cc(C2CCCCCC2)[nH]n1)[C@H]1CCCCO1 159525751 JDKBGXDKNXMVDF-CQSZACIVSA-N 291.395 3.355 70 20 CGID COC(=O)c1cc(CN2CC[C@@H]3CCCC[C@@H]32)oc1C 159651449 QSZLATMCIXNXEN-WFASDCNBSA-N 277.364 3.139 70 20 CGID CC[C@H](O)CCNC(=O)[C@@H](c1ccccc1)[C@H](C)CC 218094945 LALIVICMCSUGSA-VNQPRFMTSA-N 277.408 3.094 70 20 CGID COc1ccc([C@@H](C)N(C)CCCn2ccnc2C)cc1 161353907 YVWQWFGJUXVPGQ-CQSZACIVSA-N 287.407 3.283 70 20 CGID CS[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(Cl)cc1 161375003 QSEBOPIJLRQZTD-MNOVXSKESA-N 285.840 3.386 70 20 CGID CC[C@H](NC(=O)c1ccsc1)c1c(C)noc1C 160164295 AXXAITNWUMOITH-NSHDSACASA-N 264.350 3.234 70 20 CGID C[C@H](CC(=O)N1Cc2ccccc2C1)c1ccncc1 160459992 PXPQYCPXDABPBV-CYBMUJFWSA-N 266.344 3.118 70 20 CGID C[C@H](CC(=O)N(C)Cc1cccn1C)C(C)(C)C 160487537 ZUDYEYXAXZOTCK-GFCCVEGCSA-N 250.386 3.056 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CC[C@H](C)C[C@@H]1C 160587767 COWFBQYBNJKVTN-RYUDHWBXSA-N 299.374 3.306 70 20 CGID C[C@@H]1C[C@H](NCC(C)(C)O)c2cccc(Br)c21 160635969 ZBMYGMTYWVCIPS-SKDRFNHKSA-N 298.224 3.358 70 20 CGID CCCC1(CNC(=O)[C@@](C)(O)[C@@H](C)c2ccccc2)CC1 160681843 DAJKOYUTLRKUSZ-YOEHRIQHSA-N 289.419 3.238 70 20 CGID Cc1cccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1C 160931968 RPRVHUVMQBXITO-ZBFHGGJFSA-N 288.391 3.383 70 20 CGID CC(C)(C)c1ccc(CNC(=O)[C@H]2CCCCO2)cc1 160976056 HXEPLWQWAWUFCN-OAHLLOKOSA-N 275.392 3.169 70 20 CGID CCOCCC1(CNC(=O)c2cccc(Cl)n2)CCC1 159673416 YTAQTROVJJQGFS-UHFFFAOYSA-N 296.798 3.062 70 20 CGID CCC(CC)(CC)CNC(=O)N1CCC[C@H]1COC 159677558 FCJNUAGSTVHJGT-ZDUSSCGKSA-N 270.417 3.023 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N(C)Cc1ccco1 159514600 DOVXWZPJSXJDTP-OLZOCXBDSA-N 275.373 3.412 70 20 CGID COCCCSc1nnc(-c2cccc(Cl)c2)n1C 159734272 MFMSZWFCMSLCTF-UHFFFAOYSA-N 297.811 3.264 70 20 CGID CC[C@@H](C)CN(CC)C(=O)C[C@@H](C)c1ccncc1 161243606 SHVWMLPPQODNBM-ZIAGYGMSSA-N 262.397 3.470 70 20 CGID COC(=O)c1ccccc1NC(=O)c1cccc(C)c1F 161388410 QMBJFXFKUYTELJ-UHFFFAOYSA-N 287.290 3.173 70 20 CGID C[C@@H]1OCCN(C(=O)CCC(C)(C)c2ccccc2)[C@@H]1C 160046612 QFMMCESFLKQYSS-CABCVRRESA-N 289.419 3.380 70 20 CGID CCCO[C@@H]1CCCN(Cc2ccc(C)cn2)CC1 160108966 IZIYMOOVEYFCII-MRXNPFEDSA-N 262.397 3.171 70 20 CGID CCc1ccc([C@@H](CC)N[C@@H]2CCc3nc(C)nn3C2)cc1 160426327 NEKDMNKCAZWQDU-IAGOWNOFSA-N 298.434 3.205 70 20 CGID COc1cccc(C[C@H](NCC(C)(C)O)c2ccccc2)c1 160603618 LOWQUFCRNMVZBU-SFHVURJKSA-N 299.414 3.340 70 20 CGID CC/C=C(/C)C(=O)NCCc1csc(C(C)(C)C)n1 160749184 YYXORNFJRKFQHL-XFFZJAGNSA-N 280.437 3.456 70 20 CGID COc1ccc([C@@H](NC(N)=O)c2ccccc2Cl)cc1 160824874 FIKMLZCZIHMZCC-CQSZACIVSA-N 290.750 3.106 70 20 CGID CCOC(CCNCc1cccc2cccnc12)OCC 159414059 SJPVSURCPBZFPU-UHFFFAOYSA-N 288.391 3.114 70 20 CGID Cc1ccc(Cl)c(OC(=O)[C@@H]2CCCCO2)c1 159714470 HGVSIHNQTDDORH-NSHDSACASA-N 254.713 3.123 70 20 CGID Cc1cccc(OCCC(=O)NCC2(C3CC3)CC2)c1C 159739000 ZCNUYEVJJDLBPS-UHFFFAOYSA-N 287.403 3.379 70 20 CGID C[C@@H](c1ccccc1)[C@@H](C)NC(=O)c1cccc2[nH]cnc12 159787486 DLLYDDFWZBCIIM-CHWSQXEVSA-N 293.370 3.485 70 20 CGID CC[C@@H](C)[C@H](NCc1cc(F)cc(Cl)c1)C(=O)OC 160873310 CPGAZCDVDHRYEC-RNCFNFMXSA-N 287.762 3.156 70 20 CGID Cc1ccnc(NC(=O)NCCC2CCCCC2)c1 217305236 POSJKOPIKFDMFL-UHFFFAOYSA-N 261.369 3.482 70 20 CGID CC[C@H](C)CNC(=O)c1c(F)cccc1Br 160968763 UXMAFECIHWJKST-QMMMGPOBSA-N 288.160 3.364 70 20 CGID CCOC(=O)C1CCC(NC(=O)[C@H]2CCC[C@@H](C)C2)CC1 161347591 FSYBVMJXEALUJO-JLVJUDLZSA-N 295.423 3.051 70 20 CGID CCOc1cc(Cl)ccc1NC(=O)[C@@H]1CCC[C@@H](N)C1 161501992 XMNHZNFAAQDCTG-ZYHUDNBSSA-N 296.798 3.195 70 20 CGID CC(C)Oc1ccc(CN[C@@H](C)C(C)(C)C)cn1 160090873 WXEDUNZOJZFPHW-LBPRGKRZSA-N 250.386 3.393 70 20 CGID COc1cc(NCc2ccccc2NC(C)=O)ccc1F 160145557 AYXGSXFQZDSNCS-UHFFFAOYSA-N 288.322 3.405 70 20 CGID CC[C@@H](NC(=O)Cc1ccc(F)cc1)c1c(C)noc1C 160232282 RILGBIPQYSUOEO-CQSZACIVSA-N 290.338 3.241 70 20 CGID CCO[C@@H]1C[C@H](NCC2(N(C)C)CCCC2)C12CCCC2 160675658 HQVGSEHWRQUIER-JKSUJKDBSA-N 294.483 3.188 70 20 CGID CN(CC(=O)OC(C)(C)C)C(=O)C1CCC(C)(C)CC1 159711477 YQTSBINVUITEKS-UHFFFAOYSA-N 283.412 3.003 70 20 CGID CC1CCN(CCCNCc2cc(F)cc(F)c2)CC1 159633044 LQWXVUDLLVIJDJ-UHFFFAOYSA-N 282.378 3.176 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1ccnc(Cl)c1 159823734 KXSBRGNUZUZZHW-MWLCHTKSSA-N 252.745 3.044 70 20 CGID C[C@H](C[C@@H]1CCCCCN1)N[C@H](C)c1ccccn1 160823217 LCSOLYFWSSTYCE-KFWWJZLASA-N 261.413 3.043 70 20 CGID CC[C@H](C)[C@H](C)NC[C@@H](O)COc1ccc(C)cc1C 218781723 XLJLTAHJHJBFRE-CWRNSKLLSA-N 279.424 3.067 70 20 CGID CC[C@H](NCC1(c2ccc(F)cc2)CC1)[C@@H]1CCOC1 161371257 CXMXSOYOHUOPMV-CJNGLKHVSA-N 277.383 3.262 70 20 CGID CC[C@H]1CCCC[C@H]1NCC[S@@](=O)c1ccccc1 161424618 QRJUJLRELVUDKV-GMBSWORKSA-N 279.449 3.353 70 20 CGID Fc1ccc(F)c(Cn2nc(C3CC3)nc2C2CC2)c1 161431247 BMYVENMNHWCBLG-UHFFFAOYSA-N 275.302 3.359 70 20 CGID Cc1cccc(C)c1OCCC(=O)NCC1(C2CC2)CC1 160054027 SYHQCJOHKBVZGM-UHFFFAOYSA-N 287.403 3.379 70 20 CGID CC/C=C(/C)C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1 160166988 WGESNTOYUYHLOJ-AFYSSFTJSA-N 275.392 3.014 70 20 CGID CNC(=O)c1ccc(OC)c(NCc2sccc2C)c1 160283347 YCJWSFLMZRKAIR-UHFFFAOYSA-N 290.388 3.037 70 20 CGID Cc1cc(C)cc(C(=O)Nc2nnc(-c3ccc(C)o3)[nH]2)c1 160345217 PCIDZFNHMONMAO-UHFFFAOYSA-N 296.330 3.242 70 20 CGID COc1ccnc(CN2CCC[C@@H]2c2cccc(C)n2)c1 160388778 MCQAFMUTBJDSJF-QGZVFWFLSA-N 283.375 3.131 70 20 CGID CC[C@@H](c1ccccc1)S(=O)(=O)[C@@H](C)c1nnc(C)o1 160433051 IMHSIKXCIIEOQC-GWCFXTLKSA-N 294.376 3.005 70 20 CGID CCC[C@@H](C)NCc1cncc(Br)c1 160557272 KABFMZVMANRJHB-SECBINFHSA-N 257.175 3.122 70 20 CGID CC[C@@H](NC(=O)c1ccc(SC)o1)c1c(C)noc1C 160658194 RWFRALPXTSMRIL-SNVBAGLBSA-N 294.376 3.487 70 20 CGID CCC(=O)c1cccc(NC(=O)c2cc[nH]c2C)c1 160736080 AFJSYUQIPJDFPY-UHFFFAOYSA-N 256.305 3.168 70 20 CGID CCC[C@@H](C(=O)NOCc1cccnc1)c1ccccc1 160796527 MWBFXMSWKSLWCT-MRXNPFEDSA-N 284.359 3.213 70 20 CGID CC1(C)CCC(CNC(=O)NCCc2nccs2)CC1 160819885 OFKJMCJAUHSWTF-UHFFFAOYSA-N 295.452 3.201 70 20 CGID CC(C)NC(=O)Nc1cc(CC2CC2)nn1-c1ccccc1 160972057 VCYDELHTLMLMIL-UHFFFAOYSA-N 298.390 3.355 70 20 CGID O=C(NCc1ncc[nH]1)c1cccc(OC2CCCCC2)c1 159863771 URZNEVAFQSHTDI-UHFFFAOYSA-N 299.374 3.051 70 20 CGID CCc1onc(C)c1NC(=O)c1cc(C)nc(Cl)c1 159488423 PSNIKUQMPZJULH-UHFFFAOYSA-N 279.727 3.155 70 20 CGID CCCc1cc(C(=O)Nc2c[nH]c(=O)c(C)c2)sc1C 159512620 DGAABJOVSSINCV-UHFFFAOYSA-N 290.388 3.258 70 20 CGID C[C@@H](CCC(C)(C)C)NC(=O)C[C@H](C)C1CCNCC1 159773176 IHVMRMSWJUHKTF-KBPBESRZSA-N 282.472 3.343 70 20 CGID Cc1ccccc1[C@H](C)NC(=O)N[C@H](CCO)C(C)(C)C 161103122 WUBUDBVWNWKUPC-DZGCQCFKSA-N 292.423 3.152 70 20 CGID CN(C(=O)Nc1ccc(Cl)c(F)c1)[C@H]1CCSC1 161144228 UDQJFKPYHGGXJL-VIFPVBQESA-N 288.775 3.448 70 20 CGID Cn1nccc1CSc1ccc(C(F)(F)F)cn1 161275106 DDQDRUSOSZRILJ-UHFFFAOYSA-N 273.283 3.126 70 20 CGID CCC1CCC(CNC2CCC(NC(C)=O)CC2)CC1 161459690 PSRJYLBMWYPWRR-UHFFFAOYSA-N 280.456 3.240 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)C3CCCC3)c2C)o1 161471371 YFXXQQNXJJXRSA-UHFFFAOYSA-N 273.336 3.415 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)C3[C@@H]4CCC[C@@H]34)c2C)o1 161474520 ZJLSZIHIFOENQN-GHMZBOCLSA-N 285.347 3.271 70 20 CGID C[C@@H](C1CC1)N(C(=O)COc1ccc2[nH]ccc2c1)C1CC1 160024399 SJUTWRQXQOPFRV-LBPRGKRZSA-N 298.386 3.336 70 20 CGID CC(C)Cn1nccc1NC(=O)c1ccc(C(C)C)nc1 160128248 QUVPHVNRBWYGEI-UHFFFAOYSA-N 286.379 3.310 70 20 CGID C[C@@H](N[C@H]1CCCN(c2ccccc2F)C1=O)C1CCC1 160216085 IFLKJHUDSNBEMC-DOMZBBRYSA-N 290.382 3.099 70 20 CGID CO[C@@H](C(=O)OCc1nc(C)sc1C)c1ccccc1 160372332 VBACETDPUMVYMD-CQSZACIVSA-N 291.372 3.191 70 20 CGID CCC[C@H](C(=O)NCc1ccc(OC)c(OC)c1)C(C)C 160384136 IOOVXBZPGRZTOP-AWEZNQCLSA-N 293.407 3.392 70 20 CGID CC1(C)Cc2occc2[C@@H](NC[C@H]2CCCC[C@@H]2O)C1 160518053 FPYBXADWWRIKNH-SNPRPXQTSA-N 277.408 3.434 70 20 CGID COC(CN1CCCCC[C@H]1c1ccccc1)OC 160622119 RVECDINHOKTEON-HNNXBMFYSA-N 263.381 3.223 70 20 CGID COc1ccccc1-c1noc([C@H]2CCC(=O)C[C@H]2C)n1 160990511 NOWJSKQLILVKET-PWSUYJOCSA-N 286.331 3.218 70 20 CGID CCC1(C(=O)Nc2cc(C3CC3)nc(C)n2)CCC1 159902289 UBLYSNPXNLDTJY-UHFFFAOYSA-N 259.353 3.181 70 20 CGID COc1ccc([C@@H](C)N[C@@H]2CCCC[C@H]2OC)cc1 160080953 KVLCDICXPXCMCD-DAXOMENPSA-N 263.381 3.303 70 20 CGID Cc1ccc2cc(CN[C@H]3CCN(C)[C@@H](C)C3)ccc2n1 218365506 YRMMAWVBIRMILQ-YOEHRIQHSA-N 283.419 3.116 70 20 CGID Cc1cc2occ(CC(=O)Nc3ncccc3O)c2cc1C 216836202 IBYIXKPSDHQERN-UHFFFAOYSA-N 296.326 3.331 70 20 CGID CCCCOCCNC(=O)c1ccc2nc(C)ccc2c1 161040477 WJAIJRRWHFAVSD-UHFFFAOYSA-N 286.375 3.090 70 20 CGID C[C@H](CCC(=O)NCc1ccc[nH]1)c1ccccc1 161234929 LQNJMTXGZGPZQW-CYBMUJFWSA-N 256.349 3.215 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccc2c(c1)OCO2 161271496 FHLZACXRBHXOMF-OCCSQVGLSA-N 289.375 3.456 70 20 CGID CN1CCC[C@@H]2CN(C(=O)C3CCC(C)(C)CC3)CC[C@H]21 161306243 VOWLTPNTNPWGNG-HZPDHXFCSA-N 292.467 3.146 70 20 CGID Cc1cc(C)cc(CSc2ncnc3[nH]cnc23)c1 161370166 UMJMVDDCZVTHSS-UHFFFAOYSA-N 270.361 3.262 70 20 CGID Cc1ccc(NC(=O)NC2(c3ccccc3F)CC2)cn1 161445215 QLJHMRLTALIGPX-UHFFFAOYSA-N 285.322 3.340 70 20 CGID Cc1cccc([C@@H](C)CNC(=O)NC2(C)CCC2)c1 161481304 YOQFTBXCRNPQRL-ZDUSSCGKSA-N 260.381 3.340 70 20 CGID Cc1nccc(NC(=O)NCC2(C3CC3)CC2)c1Cl 160034789 PEBRBXUOIBMWRV-UHFFFAOYSA-N 279.771 3.355 70 20 CGID COc1cc(NCC(=O)Nc2cccc(F)c2)ccc1F 160289385 CQHLXRXJNPQGBE-UHFFFAOYSA-N 292.285 3.024 70 20 CGID C[C@H](C1CC1)N(Cc1ccccc1)C(=O)[C@@H]1CCCCO1 160848926 VXPBNOBMWFWVEI-PBHICJAKSA-N 287.403 3.383 70 20 CGID CC[C@H](CC(=O)NCC1(N)CCCCC1)c1ccccc1 159721481 CVVZNOYXBGTPTN-OAHLLOKOSA-N 288.435 3.348 70 20 CGID COc1cc(NCc2cc(O)cc(F)c2)ccc1F 160113623 UUEYUKQMDFMURE-UHFFFAOYSA-N 265.259 3.291 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCCC[C@H]2OC)c(OC)c1 218040941 WRIQNYNKHARKAM-VBNZEHGJSA-N 293.407 3.312 70 20 CGID O=S(=O)(Cl)[C@@H]1CCCC[C@@H]1c1ccccc1 88251589 RJCAPJKKRJGVKO-VXGBXAGGSA-N 258.770 3.281 70 20 CGID Cc1ccccc1[C@@H](C)NC(=O)N[C@@H](CCO)C(C)(C)C 161102835 WUBUDBVWNWKUPC-HIFRSBDPSA-N 292.423 3.152 70 20 CGID CCN(Cc1ccccc1Cl)C(=O)[C@H]1CCCCO1 161231329 RFBDGGNEAAMCLD-CQSZACIVSA-N 281.783 3.258 70 20 CGID CCCCOCC[S@](=O)c1ncc(C(C)(C)C)s1 160428710 BTXIKORYYUKSBK-GOSISDBHSA-N 289.466 3.365 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CC[C@@H](C)C[C@H]1C 160586063 FOAIDFGYZQYZKZ-VXGBXAGGSA-N 299.374 3.306 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1cccnc1Cl 160599621 VCYLUQRVWHMGJP-NEPJUHHUSA-N 297.830 3.430 70 20 CGID O=C(NC1CC=CC1)c1ccccc1OC1CCC1 160807253 UCLGWYHVYXKBJV-UHFFFAOYSA-N 257.333 3.066 70 20 CGID CC[C@H](NC[C@@H]1CCOC1)c1ccc(F)cc1F 160819827 ALSMMTLMQIURQA-HZMBPMFUSA-N 255.308 3.042 70 20 CGID Cc1cc(NC(=O)CC2CCNCC2)ccc1OC(C)C 160904202 WIYRUYAEZPJLDF-UHFFFAOYSA-N 290.407 3.110 70 20 CGID CN(C)[C@@H](CNC(=O)NCCCC(C)(C)C)c1ccco1 160907691 VRLRWRZQMVHADM-ZDUSSCGKSA-N 295.427 3.008 70 20 CGID CSc1cc(C(=O)N(C)C[C@@H]2CCCCO2)ccc1F 160950269 TVCQFTFIZSDUBN-LBPRGKRZSA-N 297.395 3.189 70 20 CGID CC[C@@H](NC(=O)N(CC)CC)c1ccc(F)cc1F 159613714 LCWMEXGJMGFQJM-CYBMUJFWSA-N 270.323 3.467 70 20 CGID CCc1ccc([C@@H](C)CC(=O)Nc2cccn(C)c2=O)cc1 159920742 SWIFREPYKIRWNZ-ZDUSSCGKSA-N 298.386 3.080 70 20 CGID Cc1cc(C)n(CCCNCc2ccc(F)cc2Cl)n1 159442535 KZTAMYQVBLMMBV-UHFFFAOYSA-N 295.789 3.472 70 20 CGID CCN(CCCS(=O)(=O)C(C)C)Cc1ccccc1C 160810194 ZOFXQEDRJFIRPT-UHFFFAOYSA-N 297.464 3.030 70 20 CGID OC[C@H](NCc1cc(F)cc(Cl)c1)c1ccccc1 160935740 NSSSZNNBDOCDQE-HNNXBMFYSA-N 279.742 3.302 70 20 CGID Cn1cc(CC(=O)N2[C@H]3C=CC[C@H]2CC3)c2ccccc21 218729201 JQSNATCECFLPIJ-GJZGRUSLSA-N 280.371 3.040 70 20 CGID CCSCCN1CC[C@H](c2ccc(OC)cc2)C1 160032802 DWRWYECFWMZJMU-AWEZNQCLSA-N 265.422 3.238 70 20 CGID CNc1ccccc1C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 217857811 KHRKDUPLEVRUDC-MBNYWOFBSA-N 260.381 3.283 70 20 CGID C[C@@H](NCCc1ccc2c(c1)OCO2)C1CCCC1 161147032 IRNBQRHDCQRUHJ-GFCCVEGCSA-N 261.365 3.126 70 20 CGID C[C@H]1CCC[C@@H](C(=O)NC2CCN(C(C)(C)C)CC2)C1 161201211 UCYQJILLRKJGOT-UONOGXRCSA-N 280.456 3.192 70 20 CGID COc1ccccc1CCNC(=O)c1cccn1C(C)C 160234574 AWDNGMITCKENSI-UHFFFAOYSA-N 286.375 3.050 70 20 CGID Cc1cc(NC(=O)NC2C[C@@H](C)O[C@H](C)C2)ccc1F 160574993 FCQURYLDMMRANT-GHMZBOCLSA-N 280.343 3.212 70 20 CGID CSCCCCC(=O)N1CCC[C@@H]1c1ccc[nH]1 159715609 WOXZLUBFLCKDEU-CYBMUJFWSA-N 266.410 3.212 70 20 CGID COc1ccc(SCCCCS(=O)(=O)Cl)cc1 100495425 JYEZHCDVDOEWMV-UHFFFAOYSA-N 294.825 3.136 70 20 CGID CS[C@@H]1CC[C@@H](Nc2ccc(C(F)(F)F)nn2)C1 218045196 LVFFQXGGAPDVAH-HTQZYQBOSA-N 277.315 3.191 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1cc(F)ccc1F 217672935 CKDMFKCRYLGAIE-UVBJJODRSA-N 280.362 3.242 70 20 CGID C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCC1CC1 217987525 FXGZZLVHUAHRNN-CXAGYDPISA-N 296.455 3.460 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1F 161038511 NFXMAOUGOGQYBE-XBFCOCLRSA-N 282.378 3.488 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@@H](C)Cc1cccc(Cl)c1 161150285 PBQGMWRXLGYZJF-SWLSCSKDSA-N 297.826 3.042 70 20 CGID Cc1ccc(CN[C@@H](C)c2ccc(-n3cccn3)cc2)cn1 161296966 UESBJVBTPOXLJT-HNNXBMFYSA-N 292.386 3.427 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)Cc1c[nH]c2cc(F)ccc12 161421575 JYPPJMUDACRUFX-GHMZBOCLSA-N 274.339 3.249 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cc(Cl)ccc1N(C)C 161501018 YWNJZLCYHDLZQS-SNVBAGLBSA-N 284.787 3.160 70 20 CGID CCC[C@@H]1SCCN1C(=O)c1scnc1CC 160253226 LUPHUTKERRNEQG-JTQLQIEISA-N 270.423 3.021 70 20 CGID COc1ccc(N(C)C(=O)[C@H](C)CSC)cc1Cl 160139819 UPHAQKWMJUKMKZ-SECBINFHSA-N 287.812 3.311 70 20 CGID CCCN1CCCN(C(=O)c2c(C)[nH]c3ccccc23)CC1 160391020 MSFCQRLWHBAORO-UHFFFAOYSA-N 299.418 3.034 70 20 CGID CCCc1cc(C(=O)N[C@H](C)CC(=O)OCC)sc1C 160668170 YSZOFLXUYHRTNU-SNVBAGLBSA-N 297.420 3.081 70 20 CGID Cc1cc(N(C)C)ccc1NC(=O)NCC1(C2CC2)CC1 159845722 PBKDNYQGAOBLHF-UHFFFAOYSA-N 287.407 3.373 70 20 CGID CCC(CC)(C(=O)Nc1c[nH]c(=O)c(C)c1)c1ccccc1 159674349 QCCKHXGLUNONLE-UHFFFAOYSA-N 298.386 3.380 70 20 CGID CC(C)c1noc([C@@H](C)N(C)OCc2ccccc2)n1 159590107 HFWMLOHKLGHGOU-GFCCVEGCSA-N 275.352 3.318 70 20 CGID CCc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159599291 VRBGDFGOPRVHPM-ZACQAIPSSA-N 271.404 3.296 70 20 CGID Cc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](C)C2)c(F)c1 218674228 DGOLAIPTXRGWEF-OLZOCXBDSA-N 278.371 3.193 70 20 CGID O=C([C@H]1C[C@H]1c1ccc(Br)cc1)N1CCCC1 217806516 HOVHKJPHKDFKPE-STQMWFEESA-N 294.192 3.175 70 20 CGID CC(C)(C)C[C@H](CO)Nc1cncc(Br)c1 161412385 LRVKJGQZRRHNLW-LLVKDONJSA-N 287.201 3.053 70 20 CGID CC[C@@H](C)CCC(=O)Nc1cccc(S(=O)(=O)F)c1 808739941 GZPJTXGDPOHLRA-SNVBAGLBSA-N 287.356 3.110 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1cscn1 160128628 UCRZNOHIKFSNCX-JTQLQIEISA-N 277.345 3.378 70 20 CGID C[C@H]1Cc2ccccc2N1C[C@@H](O)Cc1ccccc1 218671852 BLIDSAAHWBXNBU-YOEHRIQHSA-N 267.372 3.041 70 20 CGID COc1cc(Cl)c(C(=O)N(C)CCC2CC2)cc1OC 161026981 RJDYREJERXHBES-UHFFFAOYSA-N 297.782 3.229 70 20 CGID CCCN(CCO)Cc1ccc(OC)c(O[C@@H](C)CC)c1 161202465 CVECJWWLDXNOQZ-AWEZNQCLSA-N 295.423 3.077 70 20 CGID Cc1cc(C)c2c(c1)[C@@H](NC1CCN(C)CC1)CCCO2 161507696 GMOJZGXBYXOOJS-KRWDZBQOSA-N 288.435 3.201 70 20 CGID Cc1cc(Cl)ccc1C(=O)N(C)C[C@@H]1CCCCO1 160379867 YZWBDHWBBLUUQW-ZDUSSCGKSA-N 281.783 3.290 70 20 CGID C[C@H](NC(=O)Nc1cccc(Cn2cccn2)c1)C1CCC1 160569082 OOGMTVRABJFIOY-ZDUSSCGKSA-N 298.390 3.242 70 20 CGID CSc1cc(C(=O)N(C)C[C@H]2CCCCO2)ccc1F 160950387 TVCQFTFIZSDUBN-GFCCVEGCSA-N 297.395 3.189 70 20 CGID C[C@@H]1CCC[C@@H](N(C)C(=O)c2ccc(CN(C)C)cc2)C1 159908455 CGHIXZSOPQFFCR-RHSMWYFYSA-N 288.435 3.399 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H]2CCN(C)[C@H](C)C2)C1 159377312 ZERAIUAXYKNGKX-LXTVHRRPSA-N 270.486 3.123 70 20 CGID CC[C@H](NC(=O)Nc1c(F)cccc1F)[C@H]1CCCO1 159380064 MSZXMBNMIXTECK-NWDGAFQWSA-N 284.306 3.044 70 20 CGID CCONC(=O)C[C@H](C)c1ccccc1C(F)(F)F 159595069 RXVDCZSLBIOQNS-VIFPVBQESA-N 275.270 3.267 70 20 CGID CC(C)c1noc(OCc2noc(C3CCCCC3)n2)n1 159798895 YJYCCKZEDLPBIU-UHFFFAOYSA-N 292.339 3.203 70 20 CGID CN(Cc1ccc(F)cc1Cl)C[C@@H]1CCC[C@@H]1O 159463936 CVEXZZWDKFXRHD-FZMZJTMJSA-N 271.763 3.072 70 20 CGID Cc1ccc(C)c(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159561934 JZALNQYAUUNECA-BBWFWOEESA-N 271.404 3.351 70 20 CGID COc1cc(NCc2c(Cl)c(C)nn2C)ccc1F 160303404 ULWGXZHBAFGMPX-UHFFFAOYSA-N 283.734 3.142 70 20 CGID CC(C)(C)OC(=O)Nc1ccc(NCc2cc[nH]n2)cc1 159411931 UYAGFHNBPPAHKK-UHFFFAOYSA-N 288.351 3.369 70 20 CGID CC[C@H](CCO)NCc1ccc(F)c(C(F)(F)F)c1 160153043 LJCPGXJNURGXFL-SNVBAGLBSA-N 279.277 3.095 70 20 CGID C[C@H](c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](N)C1 217484527 QZWMWRCQADBGMZ-ZWNOBZJWSA-N 272.314 3.190 70 20 CGID CC[C@@H](C)N(C)CCNCc1ccc(OC(C)C)cc1 217389395 WMDUZPNULQCJFZ-OAHLLOKOSA-N 278.440 3.294 70 20 CGID C[C@H](NCc1cccc2cc[nH]c12)c1ccccn1 218063780 QAWZNFMUGAHRPV-LBPRGKRZSA-N 251.333 3.414 70 20 CGID O=C(C1CC=CC1)N1CC[C@H](Oc2ccccc2Cl)C1 161207935 SNGWDRUQLZHHLD-ZDUSSCGKSA-N 291.778 3.286 70 20 CGID Cc1ccc(N(C)C(=O)c2ccnn2C(C)C)cc1 160128384 UFZLODYOZZGOPR-UHFFFAOYSA-N 257.337 3.049 70 20 CGID CC(C)C[C@H]1CCN(Cc2cnc3ccccn23)C1 160910906 CCUAVJFZBRJABX-CQSZACIVSA-N 257.381 3.202 70 20 CGID COc1ccc(N[C@H](C)CCn2cccn2)c2cccnc12 159424885 BZGPMCUNRIFDAM-CYBMUJFWSA-N 296.374 3.331 70 20 CGID CCOC(=O)C[C@H](C)Sc1nc(C(C)(C)C)ns1 159517025 UFYUJVUAZARIDL-QMMMGPOBSA-N 288.438 3.269 70 20 CGID Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c(C)c1 159599809 OFYXEPHJKVUSSV-ZACQAIPSSA-N 271.404 3.351 70 20 CGID CCCN(Cc1ccccc1)Cc1cnn(CC)c1 160475580 VMLFSMWINGYHRZ-UHFFFAOYSA-N 257.381 3.315 70 20 CGID CN(CC1=CCCOC1)Cc1ccc(Cl)cc1 160812097 CBAXGGXCDLCREU-UHFFFAOYSA-N 251.757 3.119 70 20 CGID CC[C@H](C)N(C)CCNCc1cc(C)c(C)cc1C 217373819 JAAZZRDRYJLEAO-INIZCTEOSA-N 262.441 3.432 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cc(F)cc(F)c1 161079943 JITPDQUFQWLWEL-LYRGGWFBSA-N 282.378 3.488 70 20 CGID O=C(c1cn[nH]c1)N1CCCC[C@H]1CCCc1ccccc1 161163141 RBSGZSNQCQXIPL-KRWDZBQOSA-N 297.402 3.427 70 20 CGID COc1ccc(CC[C@@H](C)NCC2(CO)CCCC2)cc1 160080785 YHRAAHGBMOLMDP-OAHLLOKOSA-N 291.435 3.159 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CCCCCNC(C)=O 160868115 OFLHSTHJBIFCAA-HZPDHXFCSA-N 296.455 3.110 70 20 CGID Cc1ccc(F)cc1NC(=O)N(C)[C@@H]1CCSC1 159403914 JNHNTOBEPWXYFJ-LLVKDONJSA-N 268.357 3.103 70 20 CGID CCOc1ccccc1N(C)Cc1cc(OC)ccn1 159410851 YJHLIAKKRXEQJE-UHFFFAOYSA-N 272.348 3.125 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)[C@@H]1CCOc2ccccc21 159839388 NATPNQWHLOQUQH-CFVMTHIKSA-N 273.376 3.248 70 20 CGID CCOCCC1(CNC(=O)c2ccc(F)cc2C)CC1 159477586 QZBCNBKYJIJNOM-UHFFFAOYSA-N 279.355 3.071 70 20 CGID CCCCn1ncc(C(=O)NCc2ccc(C)cc2)c1C 159675143 RXRHOGWCIFIKFY-UHFFFAOYSA-N 285.391 3.230 70 20 CGID C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N(C)C[C@@H](C)O 159523429 HOYZFKSYZQXKGP-MNOVXSKESA-N 294.782 3.369 70 20 CGID C[C@@H](NC(=O)N[C@@H]1CCOC(C)(C)C1)c1ccccc1 161100553 NBALLTBLJOSYPC-TZMCWYRMSA-N 276.380 3.004 70 20 CGID Cc1nnc(NC(=O)N[C@H]2CCCc3sccc32)s1 161165799 LMPAZQBMTGXSOO-VIFPVBQESA-N 294.405 3.107 70 20 CGID CCCCOC(=O)CCN1CCC[C@@H]1c1cccc(C)n1 160107200 HHMMRUXCUWXARF-MRXNPFEDSA-N 290.407 3.260 70 20 CGID Cn1ccc(CNC(=O)CC2CCC(C)(C)CC2)c1 160428771 PQWMZGAZNUTOOF-UHFFFAOYSA-N 262.397 3.248 70 20 CGID CC1CCN(C(=O)N(C)c2ccc(F)cc2)CC1 160482115 IACPRKAKFRKWSO-UHFFFAOYSA-N 250.317 3.114 70 20 CGID O=C(NCc1ncccc1F)Nc1ccc(Cl)c(F)c1 160622745 OBBGUSVGGAMITN-UHFFFAOYSA-N 297.692 3.335 70 20 CGID C[C@H]1C[C@H]1C(=O)Nc1cc(F)ccc1OC(F)F 159498077 FISZGPSONBDLGW-POYBYMJQSA-N 259.227 3.022 70 20 CGID Cc1nccc(NC(=O)NC2(C)CCC2)c1Cl 159767442 UVSOZSFIBXBNAL-UHFFFAOYSA-N 253.733 3.108 70 20 CGID C[C@H](CC(=O)NCC1(C2CC2)CC1)c1ccccc1 159999715 KHZOGYNLDWTVEH-CYBMUJFWSA-N 257.377 3.487 70 20 CGID Cc1cccc(C(=O)N[C@H]2CCNC3(CCC3)C2)c1Cl 160386637 KUZXNEVRVWLPOJ-LBPRGKRZSA-N 292.810 3.053 70 20 CGID CC[C@](C)(CCO)NCc1ccccc1C(F)(F)F 218101744 IWFJIYBQOMXWCN-CYBMUJFWSA-N 275.314 3.346 70 20 CGID CC(C)NCCC(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 161046949 VPGNHNTWYRTURJ-CJNGLKHVSA-N 292.398 3.123 70 20 CGID Cc1ccc(OCCC(=O)NCC2(C3CC3)CC2)cc1C 160053898 LFMRWYDUADCRME-UHFFFAOYSA-N 287.403 3.379 70 20 CGID Cc1cccc(F)c1NC(=O)c1cnc(C(F)(F)F)nc1 160058395 UGKDZOCTKQTIMR-UHFFFAOYSA-N 299.227 3.195 70 20 CGID Cc1ccc(F)cc1C(=O)N[C@H]1CCOC2(CCCC2)C1 160080331 BVNVRSUPTDNMBH-AWEZNQCLSA-N 291.366 3.356 70 20 CGID CCC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 160120843 PHOHUPIECSMKFT-MRXNPFEDSA-N 254.333 3.006 70 20 CGID Cc1cccc([C@@H](NC(=O)CC2CC2)c2ccccn2)c1 160130081 AXPQDCYUPQNKAH-GOSISDBHSA-N 280.371 3.396 70 20 CGID Cc1ccc(C(=O)CCC(=O)NCC2(C3CC3)CC2)cc1 160156424 TZNZNZJVWWDZBQ-UHFFFAOYSA-N 285.387 3.264 70 20 CGID COc1cc(NCC(=O)NC2CCCCCC2)ccc1F 160268343 VANULNNJVGYFAG-UHFFFAOYSA-N 294.370 3.085 70 20 CGID Cc1cccc2ncnc(N[C@@H]3CCO[C@H](C4CC4)C3)c12 160331871 JOLSJNJINRNRCE-HIFRSBDPSA-N 283.375 3.308 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccccc1F 160390157 KCXATCHSLHNTRI-CYBMUJFWSA-N 291.366 3.437 70 20 CGID CC1(C)C[C@H]1C(=O)N1CCCN(CC2CCCCC2)CC1 160492013 LBYZLFHXAJKVRR-INIZCTEOSA-N 292.467 3.147 70 20 CGID C[C@H](CO)SCc1ccccc1Br 160721620 MXRNSXUTNUHHCT-MRVPVSSYSA-N 261.184 3.063 70 20 CGID CCc1nc2c(s1)[C@H](N(C)C(=O)C(C)C)CCC2 160987240 XJTRUCXECJQHHG-LLVKDONJSA-N 266.410 3.197 70 20 CGID CN(C(=O)[C@H]1CCCCO1)c1ccc2ccccc2c1 159908628 ANPUORHLAGEHGO-MRXNPFEDSA-N 269.344 3.372 70 20 CGID Cc1ccc([C@@H]2CCCCN2C(=O)[C@H]2CCCNC2)cc1 159913604 WJYFXUMTEXSULR-IRXDYDNUSA-N 286.419 3.048 70 20 CGID C[C@@H](c1ccc(F)cc1F)N(C)CCOCC1CC1 159764531 QGDJORUCQICJFE-NSHDSACASA-N 269.335 3.384 70 20 CGID N[C@H](CC(=O)N1CCC[C@H]2CCCC[C@H]21)c1ccccc1 218011748 CLIQTFBCHMYLNE-BRWVUGGUSA-N 286.419 3.258 70 20 CGID CC[C@H](C)CN(CC)C(=O)c1ccncc1Br 159667293 XOTSRDVEJRZNDJ-JTQLQIEISA-N 299.212 3.352 70 20 CGID CCS[C@H]1CCC[C@H]1NC(=O)c1ccc(Cl)nc1C 160654292 NJHCHGVNBFIWKD-NEPJUHHUSA-N 298.839 3.447 70 20 CGID Cn1cc(Cl)cc1C(=O)N1CCc2c(F)cccc2C1 161044581 DIOHOQJPIMAYFM-UHFFFAOYSA-N 292.741 3.016 70 20 CGID Cc1ccc([C@H](C)N(C)C(=O)[C@@H]2CCCCO2)cc1 161118123 BJDFCLZJEQJLMX-ZFWWWQNUSA-N 261.365 3.084 70 20 CGID Cc1cc(C(=O)Nc2cccc3ccccc23)ncn1 161319249 XYLLXBQEJKVBRU-UHFFFAOYSA-N 263.300 3.191 70 20 CGID CC(C)CCn1ccc(NC(=O)N2C[C@H](C)C[C@@H](C)C2)n1 161404264 CQTGFGMCINDKHK-ZIAGYGMSSA-N 292.427 3.439 70 20 CGID CCOCCC1(CNc2nc(C(C)(C)C)ns2)CC1 160067333 MQAWBBOORJETBN-UHFFFAOYSA-N 283.441 3.454 70 20 CGID c1ccc2oc(N[C@H]3CCO[C@H](C4CC4)C3)nc2c1 160318808 NEVJKAIEQJQXEZ-FZMZJTMJSA-N 258.321 3.197 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)c1ccsc1 160869641 DCIQMDJNRQWSJZ-SECBINFHSA-N 279.386 3.201 70 20 CGID Cc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@@H](C)CCO 159822107 GJCDAHIKCXMROA-GOEBONIOSA-N 292.423 3.152 70 20 CGID O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1ccc(F)cc1F 159677383 AAOYIZJJTYSICC-NHYWBVRUSA-N 294.345 3.168 70 20 CGID OC1CCC(NCC23CC4CC(CC(C4)C2)C3)CC1 216689017 KYSDBMIXFIKEOB-UHFFFAOYSA-N 263.425 3.096 70 20 CGID O=C(c1cc[nH]n1)N1CCCC[C@H]1CCCc1ccccc1 161180137 WHTTVLBUEASFHH-INIZCTEOSA-N 297.402 3.427 70 20 CGID CO[C@@H](C(=O)N1c2ccccc2C[C@H]1C)c1ccccc1 161258132 GWSCDSFBBXAIKO-CXAGYDPISA-N 281.355 3.352 70 20 CGID COc1ccc(N(C)C(=O)c2cccnc2)cc1Cl 160042529 XQMVJZRODQTIGD-UHFFFAOYSA-N 276.723 3.020 70 20 CGID Cc1ccc(C(=O)CCN2CC[C@H]3OCCC[C@@H]3C2)cc1 160321753 OSYREHNPGAIGSV-SJLPKXTDSA-N 287.403 3.069 70 20 CGID COCCC1(CNC(=O)N[C@@H]2CC[C@@H](C)C[C@H]2C)CCC1 160448730 PCPJYJBAINPKNX-RBSFLKMASA-N 296.455 3.317 70 20 CGID Cc1csc(CNC(=O)[C@H]2C[C@@H]2c2sccc2C)n1 160618071 PSHNPCHFWILVPO-QWRGUYRKSA-N 292.429 3.241 70 20 CGID CCN(Cc1nccn1C)[C@H](C)c1ccc(F)cc1 160807229 OBBLAFXPXKTXDG-GFCCVEGCSA-N 261.344 3.142 70 20 CGID Cc1c(C(=O)N(C)Cc2cccn2C)oc2ccccc12 160842979 PBZFEYNZPBGECR-UHFFFAOYSA-N 282.343 3.352 70 20 CGID CC(C)CCn1ccc(N[C@@H](C)c2nc(C3CC3)no2)n1 159888754 IXDVIEOUOPOBOL-NSHDSACASA-N 289.383 3.363 70 20 CGID Clc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)s1 159540410 DCBCARBPKXHMRL-UHTWSYAYSA-N 283.824 3.449 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCc1ccc(N(C)C)nc1 159851959 IDJSBQKXACYLBQ-CABCVRRESA-N 261.413 3.206 70 20 CGID C[C@@H](CCC(C)(C)C)NC(=O)[C@@H](N)c1ccccc1 161230525 JZRLBZQNGZUOBV-JSGCOSHPSA-N 262.397 3.017 70 20 CGID Cc1cccc(NC(=O)NCCC2CCCCC2)n1 217305166 MUZWRGCKFYGGNP-UHFFFAOYSA-N 261.369 3.482 70 20 CGID CCS[C@@H]1CC[C@H](N(C)C(=O)NC2CCCC2)C1 161434453 QUGKYBCQPZZCQD-QWHCGFSZSA-N 270.442 3.245 70 20 CGID CCC(CC)(CNC(=O)N1CCC[C@H](C)C1)SC 218003944 XWYXYSGXKBHQJV-LBPRGKRZSA-N 272.458 3.350 70 20 CGID CC[C@@H](COC)NCCc1ccc(OC(F)(F)F)cc1 161166382 SMUVJZYCJVCBFD-LBPRGKRZSA-N 291.313 3.142 70 20 CGID CC(C)[C@@H](C)CC(=O)N1CCO[C@H](c2cccs2)C1 161466151 ZJXMVWZFYKAYOS-STQMWFEESA-N 281.421 3.330 70 20 CGID COC(=O)c1cccc(NC(=O)N[C@@H](C)CC(C)C)c1 160015006 IKMCVQXKSSEADQ-NSHDSACASA-N 278.352 3.029 70 20 CGID CCOCCC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 160140967 AVRZLVIZOGZYMX-SFHVURJKSA-N 298.386 3.022 70 20 CGID CS[C@@H](C)CC(=O)Nc1cccc(-c2nccn2C)c1 160321950 HQBVAKZXDOMKKN-NSHDSACASA-N 289.404 3.167 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cc(Cl)c[nH]1 160496617 ADIOEJYAQMADMX-GFCCVEGCSA-N 296.798 3.280 70 20 CGID C[C@H](C(=O)NCCc1csc(C(C)(C)C)n1)C1CC1 160755318 PRTRXYCVGQBGLQ-JTQLQIEISA-N 280.437 3.145 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2[nH]nc3ccccc23)CC1 160963317 XELJPWIBQPJKKB-UHFFFAOYSA-N 283.375 3.381 70 20 CGID CC(=O)C[C@H](C)NC(=O)c1oc2c(C)ccc(C)c2c1C 159955434 WOAKGSGCCJNCFJ-NSHDSACASA-N 287.359 3.455 70 20 CGID Cc1cc(C)c2nc(NC(=O)[C@H]3CCCCO3)sc2c1 159383469 PFUDSOCTEHWATQ-LLVKDONJSA-N 290.388 3.421 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2Nc1ncc(Cl)cn1 159514585 JOYVYIZMJLWRPI-ZDUSSCGKSA-N 274.755 3.202 70 20 CGID Cc1ccc2nc(CN3CC[C@@H]4CCCC[C@@H]43)cn2c1 160564501 WHVHOVAVVOXSCQ-HOCLYGCPSA-N 269.392 3.407 70 20 CGID Cc1nc2ccccc2nc1N[C@H](CO)CC(C)(C)C 161420094 VOCGGHICZGKOLE-LBPRGKRZSA-N 273.380 3.147 70 20 CGID CCCC[C@H](COC)NCc1ccc(OC(C)C)nc1 160080073 JFSOFDSDZKXYNV-OAHLLOKOSA-N 280.412 3.164 70 20 CGID CCC[C@H](C(=O)NC[C@@H](c1ccco1)N(C)C)C(C)C 161053413 SSPNIMNGDIQESP-KBPBESRZSA-N 280.412 3.071 70 20 CGID COc1ccc(C)cc1[C@@H](C)NC(=O)C1=C(C)OCCC1 160185405 VLJFUZPHTAWECR-GFCCVEGCSA-N 289.375 3.265 70 20 CGID CCC[C@@H](C(=O)NCCc1ccccc1OC)C(C)C 160237276 TUGSGCYFTFSKKL-OAHLLOKOSA-N 277.408 3.426 70 20 CGID C[C@@H]1Sc2ccccc2N(C(=O)[C@@H]2CCCO2)[C@H]1C 160263658 ALNNSSUZZWFVPD-GVXVVHGQSA-N 277.389 3.081 70 20 CGID c1ccc(NCc2nc([C@H]3CCCS3)no2)cc1 160621325 CEILWDFVUPEJCO-LLVKDONJSA-N 261.350 3.250 70 20 CGID CC(C)CN(CC(C)C)C(=O)N[C@H]1CCO[C@H](C2CC2)C1 160640898 LIPZGHZZIHGFJP-HOTGVXAUSA-N 296.455 3.268 70 20 CGID CCO[C@H]1C[C@H](N(C)C(=O)NCCC(C)C)C12CCC2 160645413 PQVDPHFHMNNEAB-KBPBESRZSA-N 282.428 3.022 70 20 CGID CS(=O)(=O)CCCCSCC1CCCCC1 160957213 IKEZCTGUAIOOBA-UHFFFAOYSA-N 264.456 3.125 70 20 CGID CCC[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1cccc(F)c1F 159459667 QSDHZXYZVBZHGI-SDDRHHMPSA-N 298.377 3.309 70 20 CGID CCCCN(C)C(=O)Nc1ccn(CCC(C)C)n1 159507035 HLBXHPCEVKABEX-UHFFFAOYSA-N 266.389 3.193 70 20 CGID CNc1ccc(C(F)(F)F)cc1C(=O)NC[C@@H]1C[C@H]1C 160090249 GWTGQGMQTMMMAU-BDAKNGLRSA-N 286.297 3.133 70 20 CGID COCCN(Cc1ccccc1)Cc1nccn1C(C)C 160685690 CHGNYUDZDKVXQH-UHFFFAOYSA-N 287.407 3.113 70 20 CGID CCOCCCN1CCC[C@H]1c1ccccc1OC 160424273 YSUXPNRGPXXYEB-HNNXBMFYSA-N 263.381 3.259 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1nc(C)ncc1Cl 161076938 KGTSALAFUASCTM-DGCLKSJQSA-N 295.814 3.479 70 20 CGID CC1(NC(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)CCC1 161317271 RKINOWYQBVCJJP-SKDRFNHKSA-N 280.318 3.063 70 20 CGID CN(CCc1ccncc1)C(=O)C(C)(C)C1CCCC1 161427816 HSIQDZFBNCYNLP-UHFFFAOYSA-N 274.408 3.299 70 20 CGID O=C(CC[C@@H]1CCCO1)N1CCc2c(Cl)cccc21 161478936 XIXKUKJZOWYMFY-NSHDSACASA-N 279.767 3.188 70 20 CGID COc1cc(OC)c(NC(=O)N(C)CCC2CC2)cc1F 160018241 IYBFOZPIFFZUSG-UHFFFAOYSA-N 296.342 3.107 70 20 CGID COc1cc(NCc2ccc3c(c2)OCCO3)ccc1F 160054801 XUOPVYFBGLLNDD-UHFFFAOYSA-N 289.306 3.218 70 20 CGID Cc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)cc1F 160158709 MQOIFAMXRYHYOC-UHFFFAOYSA-N 287.290 3.139 70 20 CGID O=C(C[C@H]1CCc2ccccc21)NCC1(C2CC2)CC1 160177812 AXDBXZNQILOXQL-CQSZACIVSA-N 269.388 3.413 70 20 CGID CC(C)CC1(CNC(=O)NCc2ncccc2F)CCC1 160198004 HRBQUEAYUQEVTK-UHFFFAOYSA-N 293.386 3.236 70 20 CGID CC[C@H](C)CN(CC)C(=O)N[C@H]1CCO[C@H](C2CC2)C1 160232931 WYUJWQQMQRFIIB-QEJZJMRPSA-N 282.428 3.022 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCC1(c2ccccc2)CC1 160414702 SQRXNLNSDQYJON-ZBFHGGJFSA-N 257.377 3.271 70 20 CGID CCSCc1cccc(NC(=O)C[C@@H]2CCCN2)c1 160425378 XZWLTFIALMZXMF-ZDUSSCGKSA-N 278.421 3.020 70 20 CGID CC1CCN(C(=O)c2cc(F)c(Cl)cc2F)CC1 160564802 BUQBBXWRBDZPSP-UHFFFAOYSA-N 273.710 3.490 70 20 CGID CCCCN(CC)C(=O)Nc1cc(C(=O)OC)cs1 160927184 IBICWEDKXBZTOV-UHFFFAOYSA-N 284.381 3.189 70 20 CGID C[C@H]1CCC[C@H](CNC(=O)c2ccc(CN(C)C)cc2)C1 160980098 WFKYAOFPZVPQEM-HOCLYGCPSA-N 288.435 3.304 70 20 CGID Cc1cc(F)ccc1NC(=O)N(C)[C@@H]1CCSC1 159539639 CFYNWOMYNJGMKY-LLVKDONJSA-N 268.357 3.103 70 20 CGID C[C@@H](CNC[C@@H](O)c1ccccc1F)c1ccccc1 159740639 PFESBCYOULJRJY-SUMWQHHRSA-N 273.351 3.252 70 20 CGID Fc1cc(Cl)ccc1CNCc1ccc2c(c1)OCO2 160661034 ADLMKQVLXXIRLT-UHFFFAOYSA-N 293.725 3.498 70 20 CGID COc1ccc(N(C)C(=O)CC(F)(F)F)cc1Cl 159980044 JVHVRPNNGYMGCS-UHFFFAOYSA-N 281.661 3.264 70 20 CGID CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239061 UULCNNAGSCGARF-GWCFXTLKSA-N 299.367 3.110 70 20 CGID COc1ccc(N[C@@H]2C[C@H](C)N(C)C[C@@H]2C)cc1Cl 217908729 AGBJNBBLWXURNR-COPLHBTASA-N 282.815 3.489 70 20 CGID O[C@@H](C[C@H]1CCCN1c1ccccn1)c1ccc(F)cc1 161146240 YXFGQSIKBAGVGY-CVEARBPZSA-N 286.350 3.313 70 20 CGID CC[C@H](C)[C@H](C(=O)N1CCC(C)(O)CC1)c1ccccc1 161304861 BQCXNROEXQDWES-HOCLYGCPSA-N 289.419 3.190 70 20 CGID Clc1cccc(Cn2nc(C3CC3)nc2C2CC2)n1 161499775 QTAWUBMZOYVJGR-UHFFFAOYSA-N 274.755 3.130 70 20 CGID C[C@@H]1CCN(C(=O)Nc2ccc(N(C)C)nc2)C[C@@H](C)C1 160083735 CZOARFVNCLZDTR-OLZOCXBDSA-N 290.411 3.048 70 20 CGID C[C@@H]1CC(NC(=O)NCC2CCC(C)(C)CC2)C[C@@H](C)O1 160321604 KIGYJYPFMGICGV-CHWSQXEVSA-N 296.455 3.458 70 20 CGID c1cc2occc2c(N[C@@H]2CCO[C@H](C3CC3)C2)n1 160322435 SVPZOVFSQFHIKI-RISCZKNCSA-N 258.321 3.197 70 20 CGID CCc1noc(C)c1CS(=O)(=O)c1cccc(Cl)c1 160371358 RWEWJRORGMCGJD-UHFFFAOYSA-N 299.779 3.173 70 20 CGID CN[C@@H]1CCN(C(=O)C[C@H](C)c2ccc(C(C)C)cc2)C1 160538156 YSJMTDDVYQKWHO-WMLDXEAASA-N 288.435 3.124 70 20 CGID CC[C@H](C)C(=O)NOCc1ccc(C(F)(F)F)cc1 160662370 PDAPRLCYPDEVPY-VIFPVBQESA-N 275.270 3.299 70 20 CGID Cc1cccc(NC(=O)NCC(C)(C)[C@H](O)C(C)C)c1C 160663680 DESXVIZVBZHALJ-OAHLLOKOSA-N 292.423 3.468 70 20 CGID COc1ccc(O)c(C(=O)N2CC=C(C(C)(C)C)CC2)c1 160991660 CTGSOUHUMHDONL-UHFFFAOYSA-N 289.375 3.219 70 20 CGID C[C@H](c1ccccn1)N1CCO[C@]2(CCc3ccccc32)C1 159634402 OZSYPNIZIHSBGF-DNVCBOLYSA-N 294.398 3.317 70 20 CGID CC(=O)c1ccc(CNc2ccnc(C(C)(C)C)n2)nc1C 159699275 XEDOYIWQXBQJTN-UHFFFAOYSA-N 298.390 3.292 70 20 CGID C[C@@H](CN[C@H](C)c1ccco1)N1CCc2ccccc21 159927760 NOOMFIRROKXLNW-UONOGXRCSA-N 270.376 3.381 70 20 CGID C[C@H](CNC[C@@H](O)c1ccccc1F)c1ccccc1 159740764 PFESBCYOULJRJY-CXAGYDPISA-N 273.351 3.252 70 20 CGID NC1CCC(NC(=O)c2cc3ccc(F)cc3s2)CC1 161124226 ZSCQBZNMDOEOHN-UHFFFAOYSA-N 292.379 3.040 70 20 CGID Cc1cccc(CCC(=O)N2[C@H]3C=CC[C@H]2CC3)c1 218715599 FGBKHFRUFSLDPF-HOTGVXAUSA-N 255.361 3.247 70 20 CGID Cc1ccc([C@H](C)N[C@@H]2CCN3CCCC[C@@H]23)cc1 217678809 RKQHXNIECJWZDH-UAGQMJEPSA-N 258.409 3.272 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)NCC1(C2CC2)CC1 160237074 VPYMDTXAOSIUBL-AAEUAGOBSA-N 250.386 3.055 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c(F)c1 161035660 WJUPYKQVDGRYDQ-SWLSCSKDSA-N 292.354 3.213 70 20 CGID CC(=O)Nc1cc(NC(=O)N[C@@H](C)C2CCC2)ccc1C 161089968 BGWZEBPTFLVOPR-NSHDSACASA-N 289.379 3.264 70 20 CGID COc1cc(F)c(C(=O)Nc2ccccc2C)cc1OC 161137613 MAERTWYQDHSOJB-UHFFFAOYSA-N 289.306 3.404 70 20 CGID COc1ccc(NC(=O)CCCC(C)(C)C)cc1N 161391599 IRLKCNVUOGAPEL-UHFFFAOYSA-N 264.369 3.432 70 20 CGID CCC[C@H]1CCCN(C(=O)C[C@@H](C)C2CCNCC2)C1 161447554 REJBWALWJCFWFB-CABCVRRESA-N 280.456 3.051 70 20 CGID CCCCn1ncc(NC(=O)NC[C@H]2CC=CCC2)c1C 160061138 AVCNKSDSLQJLTE-AWEZNQCLSA-N 290.411 3.469 70 20 CGID CC(C)c1nc(C(=O)NCC2(C3CC3)CC2)cs1 160097138 INAQNZPYAPERMK-UHFFFAOYSA-N 264.394 3.187 70 20 CGID CC[C@H](C)NC(=O)c1ccccc1NCc1ccco1 160459879 OOZYULYRJMXSAY-LBPRGKRZSA-N 272.348 3.420 70 20 CGID CCC(N)(CC)CNC(=O)[C@@H](C)c1cc2ccccc2o1 160482702 HAQUJKNZGZOARB-LBPRGKRZSA-N 288.391 3.170 70 20 CGID CCc1nc2c(s1)[C@@H](NC[C@H]1CCCC[C@@H]1O)CCC2 160551668 FJQFYMXFLKGGTG-DYEKYZERSA-N 294.464 3.224 70 20 CGID CC1(C)C[C@H](NC(=O)Nc2ccc(F)c(F)c2)CCO1 160813722 ORAIQDKUQYQDEH-SNVBAGLBSA-N 284.306 3.044 70 20 CGID CC(C)NCCC(=O)Nc1cccc(Cl)c1OC(C)C 160922249 TXIZVWASIHUZAE-UHFFFAOYSA-N 298.814 3.454 70 20 CGID CC[C@H](C(=O)NC[C@@H]1CCCS1)c1ccc(F)cc1 160989872 DBCWUSWUHZNPOL-KBPBESRZSA-N 281.396 3.331 70 20 CGID CCOc1ccccc1N(C)Cc1c(C)noc1C 159429626 AICYWKZQFJNULJ-UHFFFAOYSA-N 260.337 3.327 70 20 CGID CCCc1nnc(NC(=O)c2cc(F)c(C)cc2F)s1 159837375 NBPRHDYNWUZGLW-UHFFFAOYSA-N 297.330 3.330 70 20 CGID Cc1cccc([C@@H](NC(=O)C(C)C)c2ccccn2)c1 159720325 NGXLJIULTNNCFR-MRXNPFEDSA-N 268.360 3.252 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)N1CCC[C@@H]1Cc1ccccc1 159546901 WZJJXVGYRKNEHF-KYJSFNMBSA-N 299.414 3.225 70 20 CGID CC(C)CC[C@@H]1CCCN1C(=O)NCCc1cscn1 159569262 KFZFONAHYZIUDJ-AWEZNQCLSA-N 295.452 3.296 70 20 CGID CO[C@@H]1CCC[C@H](NCc2cccc3cccnc23)C1 159435653 YVDCCJKIBQXXMM-JKSUJKDBSA-N 270.376 3.282 70 20 CGID CC(C)(C)[C@H]1CCN(C(=O)Nc2cccc(CN)c2)C1 160979213 QAPZZORXEIIAOO-ZDUSSCGKSA-N 275.396 3.045 70 20 CGID CCCCCNC(=O)NCCc1cccc(Cl)c1 217459080 VOWFOVUXDWNJRK-UHFFFAOYSA-N 268.788 3.372 70 20 CGID CC[C@@H](COC)N[C@@H](c1ccc2c(c1)OCCO2)C(C)C 161040038 BAZSQRFZQCCWPT-WMLDXEAASA-N 293.407 3.170 70 20 CGID CC[C@H](C)NC(=O)c1cccc(CN[C@@H](C)C2(C)CC2)c1 161117319 LFIYNVCVWHBCRE-KBPBESRZSA-N 288.435 3.493 70 20 CGID O=C(CC[C@H]1CCOC1)N1CCc2c(Cl)cccc21 161438743 LCEYMHILNNOTAV-NSHDSACASA-N 279.767 3.046 70 20 CGID CCc1c(-c2nc(CC(C)C)no2)cnn1CC(C)C 161506852 AWCCQTSVFAXOOL-UHFFFAOYSA-N 276.384 3.350 70 20 CGID CCOCCCC(=O)O[C@@H](C)c1cc(C)ccc1OC 160174896 YQQXNBDVPLDQIB-ZDUSSCGKSA-N 280.364 3.425 70 20 CGID CC1(C)C[C@@H](Nc2cnc3cc(F)c(F)cc3n2)CCO1 160675373 HRDXEIJWDIONMN-VIFPVBQESA-N 293.317 3.278 70 20 CGID CCCC1(CNC(=O)c2[nH]c(C)c(C(C)=O)c2C)CC1 160766452 NISOFGUDETXLLP-UHFFFAOYSA-N 276.380 3.144 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)N(C)C3CC3)c2C)c1 160880617 HCGJRZRJHIYWBT-UHFFFAOYSA-N 298.390 3.424 70 20 CGID COC(=O)c1csc(NC(=O)N(CC(C)C)C2CC2)c1 160925267 VAZCMEKDOJPAHH-UHFFFAOYSA-N 296.392 3.187 70 20 CGID CC(C)Cc1ccc(CCC(=O)NCC(F)F)cc1 159417516 PEIQIKLOXVNNHA-UHFFFAOYSA-N 269.335 3.199 70 20 CGID Cc1cc(F)c(C(=O)NCC2(C3CC3)CC2)cc1F 159638194 RZAGZGAIFLNXKU-UHFFFAOYSA-N 265.303 3.193 70 20 CGID C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccccc23)CC[C@H]1C 159677690 ZYORBJLKMBIWGJ-ZIAGYGMSSA-N 299.418 3.398 70 20 CGID CC[C@H](NC(=O)Nc1ccc2c(c1)CCC2)[C@@H]1CCCO1 159510632 RHPIJJXAHCXAFA-HOTGVXAUSA-N 288.391 3.254 70 20 CGID CC[C@@H](C)N(C)C(=O)Nc1ccnc(C)c1Cl 159450375 CZVFMBJBFFAKFD-MRVPVSSYSA-N 255.749 3.306 70 20 CGID CCc1nnc(N[C@@H]2CC[C@@H](C)[C@@H](C)C2)nc1CC 218131854 OSDLCLDLFCBSHN-GRYCIOLGSA-N 262.401 3.233 70 20 CGID Cc1ccc(SCCCCS(=O)(=O)Cl)cc1 100495413 UCHJYZMIWCWWOS-UHFFFAOYSA-N 278.826 3.436 70 20 CGID C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H]1CCCCO1 161094227 GRZZARMWRNBWGF-FZMZJTMJSA-N 281.783 3.429 70 20 CGID CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)[C@@H](C)CNC 161247313 FHXLJQVYNDMKQC-RDJZCZTQSA-N 290.451 3.020 70 20 CGID C[C@H](CN[C@H](C)C1CCOCC1)COCc1ccccc1 161315848 PHKNNEDZLWMLMS-HZPDHXFCSA-N 291.435 3.244 70 20 CGID CCCCNC(=O)[C@@H](C)SCc1c(CC)noc1C 160018728 AZJWMVWPDMPTEU-LLVKDONJSA-N 284.425 3.083 70 20 CGID CC[C@H](C)OCC(=O)N[C@H](c1ccccc1)C(F)(F)F 160479045 XZEUTJQYCAORGS-GXFFZTMASA-N 289.297 3.221 70 20 CGID CC(C)(C)c1nc(CCNC(=O)C2[C@H]3CCC[C@H]23)cs1 160653318 YPSOSCZQQMCSSL-RYUDHWBXSA-N 292.448 3.145 70 20 CGID CO[C@@H](C(=O)NCCCSCC(C)C)c1ccccc1 160696655 ZAYAFVHEJKEDFR-OAHLLOKOSA-N 295.448 3.270 70 20 CGID CC(C)c1ccc(CN(Cc2nncn2C)C2CC2)cc1 160715541 OQTFRRBIKJKQNI-UHFFFAOYSA-N 284.407 3.103 70 20 CGID CC[C@H](NC(=O)CCC1CCOCC1)c1c(C)noc1C 160719227 QULHIQWNTAWKHQ-AWEZNQCLSA-N 294.395 3.066 70 20 CGID CCc1ccc(/C=C/C(=O)N[C@@H](C)c2ncc(C)s2)o1 160837297 LJVAWHNVWDQANZ-AEZGRPFRSA-N 290.388 3.498 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1ccnc(N(C)C)c1 160925872 IDXFQHRQUDFAJD-DZGCQCFKSA-N 289.423 3.188 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCC(C)(C)C2)n1 160949614 ROMIFWZSRDBNJO-UHFFFAOYSA-N 278.400 3.193 70 20 CGID COc1ccc(CC(=O)OCc2nc(C)sc2C)cc1 159702904 MCLAWOQAQHLZKG-UHFFFAOYSA-N 291.372 3.054 70 20 CGID CC1(C)C[C@H]1C(=O)NCc1c(F)cccc1OC(F)F 159541514 KVAQZCJIUVNVPC-VIFPVBQESA-N 287.281 3.089 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCCc3sccc32)cn1 159963811 JHAAXRKUSODRGO-CYBMUJFWSA-N 272.373 3.259 70 20 CGID COc1ccc2c(c1)C[C@@H](N[C@@H]1CCOC(C)(C)C1)CC2 159976192 PVZBAYRNGIKKMV-JKSUJKDBSA-N 289.419 3.100 70 20 CGID Cc1cc(N[C@H]2CCOC(C)(C)C2)nc(C(C)C)n1 160632332 VJGTXKJSKVNUQD-LBPRGKRZSA-N 263.385 3.278 70 20 CGID CC1(C)CCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 776368051 NEUXPTIPIFRYMK-GFCCVEGCSA-N 299.367 3.110 70 20 CGID CCC[C@@](C)(O)CNCc1cccc2c1OC(C)(C)C2 217805668 AQWZEFCTOUCRAN-QGZVFWFLSA-N 277.408 3.041 70 20 CGID O=S(=O)(Cl)Cc1nc2cc(Cl)ccc2s1 100656152 FTPXQUYOUCCEJY-UHFFFAOYSA-N 282.173 3.018 70 20 CGID CC(C)N(CCS[C@H](C(N)=O)c1ccccc1)C(C)C 161071205 ZMNKSLAVPKZTTH-HNNXBMFYSA-N 294.464 3.065 70 20 CGID CNC[C@H](C)C(=O)N(C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 161454886 IXQVOHXRHZDMOZ-YNEHKIRRSA-N 296.842 3.146 70 20 CGID CC(C)(CNC(=O)/C=C/C1CCOCC1)C1CCCC1 160055899 FVWHJFIHICNOGX-BQYQJAHWSA-N 279.424 3.302 70 20 CGID CCCCS[C@H](C)C(=O)N(C)c1ccc2c(c1)OCO2 160103616 MGCZYQOCHGMTKG-LLVKDONJSA-N 295.404 3.300 70 20 CGID C[C@@H](Sc1ccccc1)C(=O)NCC1(C2CC2)CC1 160139605 PDTDDCVHIVPIKD-GFCCVEGCSA-N 275.417 3.474 70 20 CGID CN(C(=O)C1(c2ccccc2)CC1)c1ccc2c(c1)OCO2 160513407 GKBZYMDEOWZDBA-UHFFFAOYSA-N 295.338 3.110 70 20 CGID Cc1cc(C(=O)N(C)[C@@H](C)CO)c(C)n1C1CCCCC1 160548396 COXLBXBVFFLETM-ZDUSSCGKSA-N 292.423 3.063 70 20 CGID COc1cc(CCC(=O)Nc2cccnc2)ccc1Cl 160598652 ATFYUTNWMXOIAI-UHFFFAOYSA-N 290.750 3.315 70 20 CGID Cc1n[nH]c(C)c1NC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F 160793210 OUFPVACKSICMCU-GHMZBOCLSA-N 291.301 3.047 70 20 CGID Cc1nc(CC(C)C)sc1C(=O)NC1CC=CC1 160849722 DZVJHKSPSKBOCN-UHFFFAOYSA-N 264.394 3.098 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cc(C)on1 160876629 WRSGILJEIPXSDU-WCQYABFASA-N 250.342 3.024 70 20 CGID C[C@H](CC(=O)N1CCOCC1(C)C)c1ccc(F)cc1F 160959061 URDZCCBIJZXOKA-LLVKDONJSA-N 297.345 3.096 70 20 CGID CCN1CC[C@H](NC[C@@H]2CCc3ccccc32)[C@H](C)C1 160968042 PNQCOINVQSHCMY-HFTRVMKXSA-N 272.436 3.036 70 20 CGID O=C(NCC(F)F)c1occc1-c1ccc(F)cc1 159419441 LICDRGZUNXFNLU-UHFFFAOYSA-N 269.222 3.081 70 20 CGID C[C@H](Oc1ccc(Cc2ccccc2)cc1)C(=O)NC1CC1 159429221 USFGGPYQTQHBOP-AWEZNQCLSA-N 295.382 3.323 70 20 CGID CCCCn1ncc(NC(=O)N2CCC(C)(C)C2)c1C 159661771 TWQSXTYQIQPKAO-UHFFFAOYSA-N 278.400 3.255 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)c2cccnc2)C1 159665805 XFYXYZHDNKHKPA-GFCCVEGCSA-N 284.384 3.470 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)N(C)Cc1ccco1 159515004 DOVXWZPJSXJDTP-QWHCGFSZSA-N 275.373 3.412 70 20 CGID Cc1cccc(NC(=O)N(C)CCc2nccs2)c1C 159730529 LAKUWYNUWCQIIM-UHFFFAOYSA-N 289.404 3.466 70 20 CGID CNC(=O)C(C)(C)CNc1ccnc2cc(Cl)ccc12 161078262 TZKVWFFLRRCWRL-UHFFFAOYSA-N 291.782 3.072 70 20 CGID CCc1nc([C@@H](C)NC(=O)NC2(C)CCC2)cs1 161166646 MFCBCFYPPQMQAQ-SECBINFHSA-N 267.398 3.008 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C=C2CCC2)n1 161343816 WBPGNJIOKIPXRE-UHFFFAOYSA-N 282.347 3.083 70 20 CGID CCCC1(CNC(=O)Nc2ccc([S@](C)=O)cc2)CC1 161416966 HGMMTQDYKFKCRR-HXUWFJFHSA-N 294.420 3.126 70 20 CGID Cc1ccc(NC(=O)N(C)[C@H]2CCC[C@@H](C)C2)cn1 161504775 CTUKEIUWYGRTDX-RISCZKNCSA-N 261.369 3.432 70 20 CGID CCc1cccc(CC)c1NC(=O)N[C@H]1CC[C@H](O)CC1 160006221 PBSRNDLFOPMNOU-GASCZTMLSA-N 290.407 3.236 70 20 CGID Cc1nc2ccccn2c1CN1Cc2ccccc2C1 160155592 KQLYPBRXMKMTLG-UHFFFAOYSA-N 263.344 3.159 70 20 CGID Cc1nc(CC(=O)N[C@H]2CCc3ccccc32)c(C)s1 160313946 GSXRLGYSOWEHAH-AWEZNQCLSA-N 286.400 3.106 70 20 CGID CC(C)(C)c1nsc(N[C@H]2CCO[C@@H](C3CC3)C2)n1 160356526 INMAMQOQZYLADK-WDEREUQCSA-N 281.425 3.205 70 20 CGID C/C=C/COc1ccc(CC[C@H](C)NCC(C)(C)O)cc1 160615353 AXSBDBSICIXUEN-NFAHFFEMSA-N 291.435 3.323 70 20 CGID Cc1ccc(C)c(NC(=O)NCC(C)(C)[C@H](O)C(C)C)c1 160634867 IHBDPSJBEWLZLC-OAHLLOKOSA-N 292.423 3.468 70 20 CGID C[C@@H](N[C@H](CCCO)c1ccccc1)c1cncs1 160752133 BAGDKMHAHUFTMW-TZMCWYRMSA-N 276.405 3.308 70 20 CGID CC[C@H](N[C@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1F 160928159 OTYCPFVNTOXFEB-GJZGRUSLSA-N 296.361 3.015 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@H]2C2CC2)n1 160997951 PTNIZIJGQWWNGA-OLZOCXBDSA-N 296.374 3.019 70 20 CGID Cn1ncc2c1CCC[C@@H]2NCc1cc(F)cc(Cl)c1 160869588 FTWZWVQXPCCTMM-AWEZNQCLSA-N 293.773 3.380 70 20 CGID Cc1ccc(CNC(C)(C)CN(C)Cc2ccccc2)nc1 159364095 JSANUYKJLKRKRB-UHFFFAOYSA-N 297.446 3.390 70 20 CGID COC(=O)N1CC[C@@H](c2cccc(Br)c2)C1 217246256 CWUNNYVVFGGROX-SNVBAGLBSA-N 284.153 3.005 70 20 CGID COC[C@H](C)NC(=S)N(CCC(C)C)CCC(C)C 217760425 AWLRQCSRAIFTMR-AWEZNQCLSA-N 288.501 3.290 70 20 CGID CCCCOc1cccc(NC(=O)[C@H](CC)N(C)C)c1 161067502 JZWOGLKDBOQQRX-HNNXBMFYSA-N 278.396 3.144 70 20 CGID COc1ccc(N(C)C(=O)c2cc(C)c(C)o2)cc1F 161180604 YJJMDYXVTLBUFY-UHFFFAOYSA-N 277.295 3.321 70 20 CGID CCC(CC)(CN)C(=O)N(C)Cc1cc2ccccc2o1 161247353 NLNAKKDEBSKVQA-UHFFFAOYSA-N 288.391 3.156 70 20 CGID CCCNC(=O)[C@@H](C)SCc1c(C)cccc1C 161388012 WGHCCQKDORZEHU-CYBMUJFWSA-N 265.422 3.451 70 20 CGID Cc1nc(CNC(=O)NCC2CCC(C)(C)CC2)cs1 160085355 MTWBXTXDCAMMHS-UHFFFAOYSA-N 295.452 3.467 70 20 CGID CC[C@@H](C)N(C)C(=O)Nc1ccn(CCC(C)C)n1 160192185 NEARROWJCPOPNN-GFCCVEGCSA-N 266.389 3.191 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)N[C@@H]1CCCc2ccccc21 160371178 NJLGQMGMEFDUKT-SRCQZFHVSA-N 285.387 3.186 70 20 CGID C[C@H](NCC1(Sc2ccccc2)CC1)[C@@H]1CCOC1 160479371 CZGAEOFOKMGWSO-UONOGXRCSA-N 277.433 3.326 70 20 CGID CC[C@H](CC(=O)N[C@@H](CCO)C(C)C)c1ccccc1 160634229 DYABTMUALUFCAL-ZBFHGGJFSA-N 277.408 3.094 70 20 CGID CC[C@@H](NC(=O)c1cc(C)oc1C)c1c(C)noc1C 160679061 OFRCUGKEZXBFND-CYBMUJFWSA-N 276.336 3.382 70 20 CGID COCC[C@@H](C)NCc1ccnc(O[C@@H](C)CC(C)C)c1 160832658 KJKLANFKLJJFED-CABCVRRESA-N 294.439 3.410 70 20 CGID CS[C@H](C)CC(=O)Nc1nc(C2CC2)cs1 160836496 JSPKNTGJSLIMBC-SSDOTTSWSA-N 256.396 3.101 70 20 CGID Cc1ccc(C)c(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1 160915546 HSFLJYTWQGICTA-ZBFHGGJFSA-N 288.391 3.383 70 20 CGID COc1ccccc1CNC(=O)c1cccn1C(C)C 160934466 UWYSRUYLDIEGPL-UHFFFAOYSA-N 272.348 3.008 70 20 CGID CCCC(O)(CCC)CC(=O)N1CCC[C@@H]1c1ccc[nH]1 159773528 JOPKFNGGQLWFSF-OAHLLOKOSA-N 292.423 3.400 70 20 CGID COc1cccc(-c2noc([C@H]3CCC(=O)C[C@H]3C)n2)c1 161013822 LFWBHBLRYZCUMJ-YGRLFVJLSA-N 286.331 3.218 70 20 CGID CS[C@@H](C)CNC(=O)[C@@H](C)Cc1ccccc1Cl 161310520 BAAHPKDPQURDCO-QWRGUYRKSA-N 285.840 3.386 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](C)C(C)C)o1 161406525 BPXWKZNWVXFCBX-JSGCOSHPSA-N 279.380 3.382 70 20 CGID CCc1nn(C)c(CC)c1CNCCc1cccc(C)c1 161450486 LSMYURUORDXRFB-UHFFFAOYSA-N 285.435 3.186 70 20 CGID CCCOc1ccc(NC(=O)N[C@@]2(C)CCOC2)c(C)c1 161481966 BRKIXKQXJLJZLJ-INIZCTEOSA-N 292.379 3.084 70 20 CGID CCCn1nccc1CNc1cccc(NC(=O)OC)c1 160098474 XHJQXJXIMHYZHM-UHFFFAOYSA-N 288.351 3.084 70 20 CGID CC[C@H](NCC1(CO)CCCC1)c1ccc2c(c1)CCO2 160121001 VEKPBMYZPIUBIB-INIZCTEOSA-N 289.419 3.215 70 20 CGID CSC[C@@H](CCO)N[C@H](Cc1ccc(F)cc1)C(C)C 160279304 GEWWQTLFNJEYHO-HZPDHXFCSA-N 299.455 3.096 70 20 CGID Cc1cc2c(N[C@H]3CCO[C@H](C4CC4)C3)ncnc2s1 160357553 NYBVFAQSLXWOFC-AAEUAGOBSA-N 289.404 3.369 70 20 CGID CCCN(CCN(CC)CC)C(=O)Nc1nc(C)cs1 160543833 IXGPLCRMHOFGIL-UHFFFAOYSA-N 298.456 3.037 70 20 CGID CCc1ccc([C@H]2CCCCCN2C(=O)NCCOC)o1 160807955 VGOCXHCVDOUFDL-CQSZACIVSA-N 294.395 3.115 70 20 CGID CCOc1ccc(OC)cc1N[C@@H](C)CCn1cccn1 159451273 SKLVPGYOVLIISF-ZDUSSCGKSA-N 289.379 3.181 70 20 CGID CC[C@H](NC(=O)Nc1cc(C)ccc1F)[C@H]1CCCO1 159478174 QPZVCJXQKGTGCX-GXTWGEPZSA-N 280.343 3.213 70 20 CGID CCC(C)(CC)C(=O)NC[C@H](C)c1nc(C)cs1 159479541 ZPZYORXPSRVTED-JTQLQIEISA-N 268.426 3.498 70 20 CGID CC(C)(C)[C@H]1CCN(C(=O)CC[C@H](N)c2ccccc2)C1 159500783 ZMBILOBNFGLLGL-HOTGVXAUSA-N 288.435 3.361 70 20 CGID Cc1nccc(NC(=O)N2CCS[C@H](C)C2)c1Cl 159723678 RVLHMRYZWPJPOU-MRVPVSSYSA-N 285.800 3.013 70 20 CGID CCCCCC(=O)N[C@@H]1CCOC2(CCCC2)C1 159534899 YMTXBTUWWNPWBN-CYBMUJFWSA-N 253.386 3.175 70 20 CGID NC(=O)c1cccc(NCc2ccc(Cl)cc2F)c1 160661784 QOWAJTBGKXHQBW-UHFFFAOYSA-N 278.714 3.190 70 20 CGID O=C(CC1CCCCC1)Nc1ccc(S(=O)(=O)F)cc1 864237966 SXGCWCWKIXKCFK-UHFFFAOYSA-N 299.367 3.254 70 20 CGID CC1(C)CC(NC(=O)C2(C)CCCCC2)CC(C)(C)N1 161287717 ZDZIFWDRQITXMC-UHFFFAOYSA-N 280.456 3.382 70 20 CGID Cc1cc([C@H](C)N[C@@H]2CCN3CCCC[C@@H]23)c(C)o1 217699116 JPJGRGKSSMZWDR-MAZHCROVSA-N 262.397 3.174 70 20 CGID CCCC(O)(CCC)CC(=O)Nc1cc([C@@H]2C[C@H]2C)n[nH]1 161035027 JAKSUUZZFMJRAU-VXGBXAGGSA-N 293.411 3.193 70 20 CGID C[C@@H](CC(=O)N[C@@H]1CCCC1(C)C)c1ccncc1 161294792 MBMLEZGVBFUWJU-GXTWGEPZSA-N 260.381 3.270 70 20 CGID O=C(CC[C@H]1CCCO1)N1CCc2c(Cl)cccc21 161479046 XIXKUKJZOWYMFY-LLVKDONJSA-N 279.767 3.188 70 20 CGID c1ccn2c(CN3CCS[C@H]4CCCC[C@@H]43)cnc2c1 161441173 YUIQXBVLJVTHCC-GJZGRUSLSA-N 287.432 3.194 70 20 CGID Cc1ccc(CC(=O)N2CCc3c(Cl)cccc32)cn1 161490091 UCIFEKHSVIAUQX-UHFFFAOYSA-N 286.762 3.175 70 20 CGID CC[C@@H](C(=O)NCCCOC(C)C)c1ccc(F)cc1 160012805 YGADUGMUKQOUCX-OAHLLOKOSA-N 281.371 3.251 70 20 CGID Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3C3CC3)cc2)n[nH]1 160474531 OCOPQYPGCLTVIJ-LSDHHAIUSA-N 297.358 3.495 70 20 CGID Cc1ncc(CN[C@H]2CCOC(C)(C)C2)n1-c1ccccc1 160528436 YWRNETGYBYIWNZ-HNNXBMFYSA-N 299.418 3.228 70 20 CGID CC(C)Sc1ccccc1NC(=O)[C@@H]1CCCN1C 160930719 WOMYAMGBGNZIIX-ZDUSSCGKSA-N 278.421 3.220 70 20 CGID COc1cc(C(=O)Nc2cc(Cl)ccc2O)ccc1F 159655807 LXESHNKSXNFVPX-UHFFFAOYSA-N 295.697 3.446 70 20 CGID Cc1cccc2nc(CNC(=O)[C@@H](C)c3cccs3)cn12 159656634 VPPNQLJUKLTSOR-LBPRGKRZSA-N 299.399 3.124 70 20 CGID COc1ccc(C)c2c1N(Cc1cccnc1)CCC2 159659808 QURAAXVBXTZGBW-UHFFFAOYSA-N 268.360 3.351 70 20 CGID CC(C)[C@@H](C)CC(=O)N[C@H]1CCOC2(CCCC2)C1 159874159 KJZVTIMLGCHQLJ-KBPBESRZSA-N 267.413 3.277 70 20 CGID CC1(C)CCC(C(=O)N2CCC(n3cccn3)CC2)CC1 159690521 APOCGLLTDXMHGP-UHFFFAOYSA-N 289.423 3.263 70 20 CGID CSCc1ccc(NC(=O)NC2CC=CC2)cc1 159756740 HJEJAKUVISAJJT-UHFFFAOYSA-N 262.378 3.390 70 20 CGID CCc1nnc(NC(=O)c2ccc(Cl)cc2C)s1 159992246 UAAAOPIVNHSDNB-UHFFFAOYSA-N 281.768 3.315 70 20 CGID CCNc1ccc(Cl)cc1C(=O)NCC(C)(C)OCC 159754414 VSGZXVBENQXMAL-UHFFFAOYSA-N 298.814 3.317 70 20 CGID CCN(Cc1cnn(C)c1)Cc1csc(C(C)C)n1 161124066 HNNIBPYUIWGGEQ-UHFFFAOYSA-N 278.425 3.022 70 20 CGID CC[C@H](N[C@H](C)C(=O)OC(C)(C)C)c1nc(C)cs1 160889740 GVHCQDKHZXFSNX-MNOVXSKESA-N 284.425 3.222 70 20 CGID CCCCNC(=O)NCCc1cccc(Br)c1 217304888 BUQXDWUWDLVRDK-UHFFFAOYSA-N 299.212 3.091 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)COc1ccc(F)c(Cl)c1 161460224 QSDIRKYPKYULBO-UWVGGRQHSA-N 285.746 3.257 70 20 CGID CCCN(CCO)Cc1ccc(F)c(C(F)(F)F)c1 161213794 QFQHMWQZLMNYBF-UHFFFAOYSA-N 279.277 3.049 70 20 CGID CC[C@@H](C)OCC(=O)Nc1ccc(Cl)c(NC(C)=O)c1 161278122 DRXRHIFIVGIABZ-SECBINFHSA-N 298.770 3.052 70 20 CGID Cc1ccc(OC(F)F)c([C@@H](C)NC2CCN(C)CC2)c1 161428289 DSEREDKZRZCJDP-GFCCVEGCSA-N 298.377 3.341 70 20 CGID Cc1ccccc1CN1CCC([C@H](O)C(F)(F)F)CC1 161493201 OHDZUEQXDKUUPZ-AWEZNQCLSA-N 287.325 3.130 70 20 CGID CC[C@@H](C)NCCC1CCN(CC(F)(F)F)CC1 160013295 RDJUMYAXCAYAKB-LLVKDONJSA-N 266.351 3.039 70 20 CGID CC[C@H](NC(=O)c1ccc(F)c(F)c1)c1c(C)noc1C 160055160 QFRABMOCYLYJTN-ZDUSSCGKSA-N 294.301 3.451 70 20 CGID CC(C)(C)SCCCC(=O)N1CCOC2(CCCC2)C1 160078108 WKQDGVGRCHJBPV-UHFFFAOYSA-N 299.480 3.470 70 20 CGID CCN(CCc1nccs1)c1nc(C(C)(C)C)ns1 160101851 YOONBIJWJBHIRX-UHFFFAOYSA-N 296.465 3.361 70 20 CGID C[C@@H]1CN(C(=O)NC(C)(C)C)C[C@@H](c2ccsc2)O1 160185980 IJBPNEBROGIURX-PWSUYJOCSA-N 282.409 3.018 70 20 CGID CCOCCC1(CNC(=O)N[C@@H](C)CC(C)C)CCC1 160630022 YCZDRZNNAVFCGM-AWEZNQCLSA-N 284.444 3.317 70 20 CGID CCCOc1cccc(CC(=O)N[C@H](C)c2cccnc2)c1 160670069 IGVUJKNCWKBMIV-CQSZACIVSA-N 298.386 3.290 70 20 CGID COc1cccc(OCCCN[C@H](C)c2cccnc2)c1 160993513 BMVGFSJLSGIIMI-CQSZACIVSA-N 286.375 3.210 70 20 CGID C[C@H](CCn1cccn1)Nc1ccc2ncccc2c1 159403739 KIBFHCVKTVUZKA-CYBMUJFWSA-N 266.348 3.322 70 20 CGID CC(C)(C)c1nsc(NC[C@@](C)(O)c2ccsc2)n1 159605163 FUCRGDJJUUTCAJ-CYBMUJFWSA-N 297.449 3.217 70 20 CGID CCC(CC)[C@H]1C[C@@H](N[C@@H](C)CCn2cccn2)CCO1 159496768 OGOPAYLUYGQQPN-BHYGNILZSA-N 293.455 3.235 70 20 CGID CCOC1CC(Nc2ccc(OCC(F)(F)F)nc2)C1 159725894 XUVCNGJOOHLUMS-UHFFFAOYSA-N 290.285 3.002 70 20 CGID C[C@@H]1C[C@@H](NCC(C)(C)O)C[C@H](c2ccccc2)C1 160659437 OTCWJWWULOBEKU-NUEKZKHPSA-N 261.409 3.319 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C)nc1 161231571 CYSNLSVTLVSGKQ-HIFRSBDPSA-N 260.381 3.431 70 20 CGID CSc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)cc1 217633184 ZTYFXNHGVLVJPE-CVEARBPZSA-N 276.449 3.125 70 20 CGID C[C@@H](NCc1cccc2cc[nH]c12)c1ccccn1 218063714 QAWZNFMUGAHRPV-GFCCVEGCSA-N 251.333 3.414 70 20 CGID CC(=O)NC1CCC(Nc2cccc3c2CCCC3)CC1 161327502 PJXSLLAPIOKIRA-UHFFFAOYSA-N 286.419 3.425 70 20 CGID CCCCOc1ccc(CCN[C@@H](C)[C@@H]2CCOC2)cc1 161387946 QBFHLDJGZGCMIJ-DOTOQJQBSA-N 291.435 3.423 70 20 CGID C[C@H]1CCN(C(=O)Nc2cccnc2Cl)C[C@@H]1C 160006853 GTZMWRQEDWUEMA-UWVGGRQHSA-N 267.760 3.245 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@H]1CC1(Cl)Cl 160100735 YCVPZMRWZGPNQH-BDAKNGLRSA-N 290.215 3.436 70 20 CGID CCC(CC)NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 160109232 HDPDLZQSBPMUHA-OAHLLOKOSA-N 292.379 3.164 70 20 CGID COc1ccc(OCCNc2ccc(F)c(OC)c2)cc1 160289518 HGLACJUIRJYBRB-UHFFFAOYSA-N 291.322 3.334 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](C)[C@@H](C)CC)c1 160566056 QRCVWGDZMUVWEN-KBPBESRZSA-N 276.424 3.351 70 20 CGID Cc1cc(C)c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)o1 159654939 QZOVBJXSRGHAOI-CYBMUJFWSA-N 277.364 3.118 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@H]2C[C@H]2C)C1 159528117 OHZHKVQVCWFOPC-TUAOUCFPSA-N 261.390 3.417 70 20 CGID CC(C)(C)CCC(=O)NCc1nc2ccccc2[nH]1 159817645 WRXWHDDAMKSBTI-UHFFFAOYSA-N 259.353 3.005 70 20 CGID C=CCCC1(C(=O)Nc2cccc(S(=O)(=O)F)c2)CC1 460092500 MRBDSAMFZYWCNH-UHFFFAOYSA-N 297.351 3.030 70 20 CGID C[C@@H](OCC1CC1)C(=O)N1CCc2c(Cl)cccc21 161477214 QBSMFLMHQFVDAJ-SNVBAGLBSA-N 279.767 3.044 70 20 CGID C[C@@H](c1cccc2ccccc12)N1CCC[C@@H](N)C1 217491878 PNTPXZZIXQNRDM-DZGCQCFKSA-N 254.377 3.324 70 20 CGID Cc1nc(CC(=O)Nc2ncc(Cl)s2)c(C)s1 161248291 UVTLENMSNRJJHQ-UHFFFAOYSA-N 287.797 3.051 70 20 CGID CC1(NC(=O)CCC(C)(C)c2ccccc2)CCOCC1 161404345 PPMJAKSIXARYBL-UHFFFAOYSA-N 289.419 3.430 70 20 CGID Cc1nc2ccccn2c1CN(C)[C@H](C)C1(C)CC1 161442922 POIUEOFCZRKTBL-CYBMUJFWSA-N 257.381 3.263 70 20 CGID Cc1cncc(C(=O)N[C@@H]2CCCc3sccc32)c1 160196079 ZVDODGJOEIAYDZ-CYBMUJFWSA-N 272.373 3.259 70 20 CGID CCc1nc(CN[C@@H](CC)C(C)(C)c2ccccc2)n[nH]1 160625463 YUCFMCCFPHYRLW-AWEZNQCLSA-N 286.423 3.213 70 20 CGID C[C@@H](C(=O)Nc1cccc(OCCF)c1)C1CC1 160649961 JUYCQHNYBYEKPX-SNVBAGLBSA-N 251.301 3.020 70 20 CGID C[C@@H](CO)SCc1ccccc1Br 160721493 MXRNSXUTNUHHCT-QMMMGPOBSA-N 261.184 3.063 70 20 CGID CCNC(=O)N1CCCCC[C@H]1c1ccc(CC)o1 160805072 WMQHAPHJIWDIPS-ZDUSSCGKSA-N 264.369 3.489 70 20 CGID CC(C)C[C@H](C)NC(=O)NCCc1cc2ccccc2[nH]1 160805504 DSXZZDGFXJWLFW-ZDUSSCGKSA-N 287.407 3.444 70 20 CGID COC(C)(C)C[C@@H](C)Nc1nc(C(C)(C)C)ns1 159659919 SREIRXOIUPSVGK-SECBINFHSA-N 271.430 3.451 70 20 CGID CC(C)[C@H]1CCN(C(=O)C[C@H]2CNc3ccccc32)C1 159593317 NVGDTYKSYIJOFD-KBPBESRZSA-N 272.392 3.090 70 20 CGID C[C@H](CNCc1cc(F)cc(Cl)c1)CN1CCCC1 160935157 PKHYUGFEQOCRFF-GFCCVEGCSA-N 284.806 3.301 70 20 CGID O=C(N[C@H]1CCCC[C@@H]1O)c1cc2ccc(F)cc2s1 161191923 JFVBPKWDPQMJAJ-RYUDHWBXSA-N 293.363 3.074 70 20 CGID CCCNC(=O)c1ccc(NC(=O)OC(C)(C)C)c(C)c1 159591396 RPGJREBWGFCRGU-UHFFFAOYSA-N 292.379 3.482 70 20 CGID Cc1cc(C)nc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 160224301 HIZHSRSFEGFKOK-SUMWQHHRSA-N 296.418 3.026 70 20 CGID C[C@H](CO)SCc1cc(Br)ccc1F 160772116 VXFNJVCRLBIFOY-SSDOTTSWSA-N 279.174 3.202 70 20 CGID Cc1ccc2[nH]c(C(=O)NC3CC=CC3)cc2c1C 160806756 NWQNDOFNDGKYCE-UHFFFAOYSA-N 254.333 3.233 70 20 CGID CC[C@H](N[C@@H](C)CCOC)c1ccc(F)cc1F 160859311 XUXOTXSIMCCAKD-HZMBPMFUSA-N 257.324 3.431 70 20 CGID O=C(CCC1CC1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159442862 BZSJLKTUSWMTME-RDJZCZTQSA-N 287.403 3.461 70 20 CGID CCOC(C)(C)CNC(=O)c1ccc2[nH]c(C)c(C)c2c1 159696962 BJOPNAJDKUFIKA-UHFFFAOYSA-N 288.391 3.330 70 20 CGID CO[C@@H](CNC(=O)CCCCSC)c1ccccc1 159397238 AFZZGSHEHLJGNI-AWEZNQCLSA-N 281.421 3.024 70 20 CGID NC(=O)c1ccc(F)c(NCc2cc(Cl)ccc2F)c1 160717323 YWLBMRTYCALNIY-UHFFFAOYSA-N 296.704 3.329 70 20 CGID CCCCOCCCNc1nc2ccccc2n1C 161081892 PVTKJKSAIHYURR-UHFFFAOYSA-N 261.369 3.192 70 20 CGID CC[C@@H](NCCC(C)(C)O)c1nc(C(F)(F)F)cs1 159741841 ALBGKCCOPSRQTK-MRVPVSSYSA-N 296.358 3.364 70 20 CGID CCOCCC1(CNC(=O)N(C)CC2CCCC2)CC1 161344018 FRUIFPHVVLZSOM-UHFFFAOYSA-N 282.428 3.025 70 20 CGID CC1(O)CCN(C(=O)Nc2cccc3ccccc23)CC1 161184541 XNFLWSFXAYLZPT-UHFFFAOYSA-N 284.359 3.219 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1scnc1C 161227747 SCGPXPFOEUJUJQ-NEPJUHHUSA-N 266.410 3.492 70 20 CGID Cc1cccc(C)c1CSCC(=O)NCc1ccco1 161383944 PSGZKJBCBZMILM-UHFFFAOYSA-N 289.400 3.446 70 20 CGID COc1ccc(N(C)C(=O)CC[C@@H]2CCCO2)cc1Cl 160132378 OAZZDMPMGFDRGN-LBPRGKRZSA-N 297.782 3.271 70 20 CGID COc1ccc(CCC(=O)NCC2(C3CC3)CC2)cc1F 160133512 IQPADWUWKNFBMW-UHFFFAOYSA-N 291.366 3.073 70 20 CGID CCCCn1ncc(NC(=O)N[C@@H]2C[C@H]2CCC)c1C 160262271 FMDCMZSVWZBULK-CHWSQXEVSA-N 278.400 3.302 70 20 CGID CC(C)C[C@H](C)NC(=O)NC[C@@]1(C)CCCS1 160277644 IEEMDGCYPIVBMG-WCQYABFASA-N 258.431 3.006 70 20 CGID CCCCc1ccc(C(=O)NCC2(CO)CCCC2)cc1 160301923 KLRBYAAFTKEAMJ-UHFFFAOYSA-N 289.419 3.312 70 20 CGID CCS[C@H](C(=O)Nc1cc(C2CC2)nc(C)n1)C(C)C 160318087 LVJWQPJCKPTOOF-AWEZNQCLSA-N 293.436 3.379 70 20 CGID CCCCOCC[S@@](=O)c1ncc(C(C)(C)C)s1 160428580 BTXIKORYYUKSBK-SFHVURJKSA-N 289.466 3.365 70 20 CGID COCCOc1cc(C)ccc1NC(=O)C[C@H](C)SC 160444090 ZHOIQIAUROSNCS-LBPRGKRZSA-N 297.420 3.100 70 20 CGID CN(Cc1cccc(F)c1)Cc1c[nH]nc1-c1cccnc1 160468689 VGMIHQAOJRBSDX-UHFFFAOYSA-N 296.349 3.243 70 20 CGID COCCOc1ccc(NC(=O)N[C@H](C)C2CCC2)cc1 160591692 MEQBZHQNZNRDEN-GFCCVEGCSA-N 292.379 3.022 70 20 CGID CN(Cc1ccc(N2CCCC2)nc1)Cc1ccccc1F 160727754 CURDLFQCPWCVIR-UHFFFAOYSA-N 299.393 3.453 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@H]2CCOC(C)(C)C2)c1 160941130 LEVUARJDCZGCBZ-NSHDSACASA-N 280.343 3.213 70 20 CGID CC(C)c1cc(C(=O)Nc2cccc(Cl)n2)no1 159628392 NIIBZYVUCRIIQT-UHFFFAOYSA-N 265.700 3.099 70 20 CGID Cc1ccc(NC(=O)N(C)[C@H]2CCSC2)c(F)c1 159438323 MQHJSLVFSMZMPE-JTQLQIEISA-N 268.357 3.103 70 20 CGID CN(CCc1nccs1)C(=O)Nc1cc(F)ccc1F 159886560 LVEFCCJTPQREHZ-UHFFFAOYSA-N 297.330 3.128 70 20 CGID CCc1nn(C)c(CC)c1CNCCCC(C)C 159745457 YUANFBULALWHKK-UHFFFAOYSA-N 251.418 3.071 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2Nc1ncccc1F 159494034 KFEBWGBGWFUZAQ-CQSZACIVSA-N 257.312 3.292 70 20 CGID CS[C@@H](C)CNC(=O)c1cc2ccccc2cc1O 159437656 KMEDEOSPRNSVCN-JTQLQIEISA-N 275.373 3.027 70 20 CGID CSc1cc2c(cc1CNC1(C)CCC1)OCCO2 159929055 HZYWLOGXDBJZGM-UHFFFAOYSA-N 279.405 3.212 70 20 CGID CCOc1ccc(CNC(=O)NCc2cccc(C)c2)cc1 217301057 PECUFSZOEHARRU-UHFFFAOYSA-N 298.386 3.393 70 20 CGID CCOC(=O)[C@H]1CCCN(Cc2ccc(F)c(Cl)c2)C1 218305960 QHBZMTLPSGMFBW-LBPRGKRZSA-N 299.773 3.254 70 20 CGID O=C(C1CCC1)N1CC[C@H](Oc2ccccc2Cl)C1 161351612 HTEKQHTWZPZTCI-LBPRGKRZSA-N 279.767 3.120 70 20 CGID CCCn1nccc1CNCc1ccccc1COCC 160092661 IRCSXASDVKODAQ-UHFFFAOYSA-N 287.407 3.119 70 20 CGID CCC(CC)n1ncc(C(=O)N2C[C@@H]3CC[C@H]2C3)c1C 160721704 SGBXIUMEGCZZDI-OCCSQVGLSA-N 275.396 3.177 70 20 CGID Fc1cc(-c2nc([C@@H]3CCOC3)no2)c(F)cc1Cl 160888307 RZXVZTVPKSIDDV-ZCFIWIBFSA-N 286.665 3.172 70 20 CGID CC1(NC(=O)N[C@H]2CCc3ccc(F)cc32)CCC1 160918279 GWTSVRJAQOMCOX-ZDUSSCGKSA-N 262.328 3.055 70 20 CGID c1ccc2c(c1)OCCC[C@H]2N[C@H]1CCCSC1 159608839 ZTPLCCXOAMJPNP-GXTWGEPZSA-N 263.406 3.386 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)CSCc1cccnc1 159513846 YJYNMLBQIKGULS-KGLIPLIRSA-N 278.421 3.010 70 20 CGID COc1cc(C)ccc1[C@@H](C)NCC1(CO)CCCC1 160092526 SXAYKRPMPPOWTL-CQSZACIVSA-N 277.408 3.207 70 20 CGID COc1ccc(C)cc1Cn1cnc2ccccc21 160866678 IIFVUTLGUFVNCV-UHFFFAOYSA-N 252.317 3.402 70 20 CGID CCCCOC(=O)c1ccccc1NC(=O)NC(C)C 217312800 CIKVSRKKFMVHFJ-UHFFFAOYSA-N 278.352 3.173 70 20 CGID C[C@@H]1CCC[C@@H](N[C@H](C)c2ccc(NC(N)=O)cc2)C1 217605900 RRWBVEZWLOXVGX-LALPHHSUSA-N 275.396 3.407 70 20 CGID C[C@H]1C[C@H]1c1ccc(CNCCNC(=O)OC(C)(C)C)o1 218118222 GNIUMPNSCRORRY-WCQYABFASA-N 294.395 3.017 70 20 CGID C[C@H]1CCN(C(=O)Nc2cc(C(C)(C)C)on2)C[C@@H]1C 161084484 HGDLSDRFZSYQOF-QWRGUYRKSA-N 279.384 3.482 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CCCCCCC1 161220328 SWHWBYJEBNWVRI-UHFFFAOYSA-N 299.374 3.451 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cccc(C)n1 161284428 CQPXIRVDYCVSRR-HIFRSBDPSA-N 260.381 3.431 70 20 CGID C[C@H]1CCN(C(=O)NCc2cc3ccccc3[nH]2)C[C@H]1C 161292915 YPMZJVXTBYGYPY-QWHCGFSZSA-N 285.391 3.355 70 20 CGID Cc1ccccc1[C@@H](C)NC(=O)N[C@H]1C=CCCC1 161345317 NBFDNDTZIRMHDV-KGLIPLIRSA-N 258.365 3.464 70 20 CGID CC[C@H]1CCCC[C@H]1NCc1cccc(C(=O)NC)c1 161415808 TWWAXJLJVDUFDO-GOEBONIOSA-N 274.408 3.105 70 20 CGID CC(C)(C)CC(=O)N[C@H]1CCOC2(CCCCC2)C1 160279158 YMJSFRWOZLHPAA-ZDUSSCGKSA-N 267.413 3.421 70 20 CGID Cc1nc2ccccn2c1CN1CCC[C@@H]2CCC[C@@H]21 160790213 NIMCDCMYHBFSNI-GJZGRUSLSA-N 269.392 3.407 70 20 CGID CCCC[C@@H](CC)CNC(=O)NOCc1cccnc1 160976659 DNZQQVFCHZNLDY-CYBMUJFWSA-N 279.384 3.029 70 20 CGID CC[C@@H]1CCCCN1C(=O)Nc1cc(C(=O)OC)cs1 160980863 TURCFROAYHZORX-LLVKDONJSA-N 296.392 3.331 70 20 CGID CC[C@@H](C(=O)NC[C@H]1CCCS1)c1ccc(F)cc1 160990223 DBCWUSWUHZNPOL-ZIAGYGMSSA-N 281.396 3.331 70 20 CGID C[C@H]1SCCN(CCn2ccnc2)[C@H]1c1ccccc1 159834439 YXFMJZNZDCUPCO-GDBMZVCRSA-N 287.432 3.062 70 20 CGID c1cnc2ccc(CN[C@H]3[C@H]4CCO[C@@H]4C34CCC4)cc2c1 159478414 YAPOJXIEQDOQEW-NJAFHUGGSA-N 294.398 3.282 70 20 CGID O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)C1CC=CC1 159490682 ZTEHVDIHMUTVFB-RHSMWYFYSA-N 285.387 3.237 70 20 CGID C[C@H](CCn1cccn1)Nc1ccccc1N1CCCC1 159363291 DJJXRWZLFQAGOJ-OAHLLOKOSA-N 284.407 3.374 70 20 CGID C[C@@H](CCn1cccn1)Nc1ccccc1OC(F)F 159392342 QZMKJBPUTYDWOO-NSHDSACASA-N 281.306 3.375 70 20 CGID COc1ccc(CCNc2ccc(F)c(OC)c2)cc1 160244448 PRDINAWESIDAPV-UHFFFAOYSA-N 275.323 3.498 70 20 CGID Cc1ccc(C(=O)N2CCC3(CCCCC3)C2)cc1N 161197112 CVORIVVQJSQWDZ-UHFFFAOYSA-N 272.392 3.374 70 20 CGID Cc1cnc(NC(=O)c2cc(F)cc3cccnc23)s1 161043739 SSKSBSLYECRQDE-UHFFFAOYSA-N 287.319 3.391 70 20 CGID COc1ccc(N(C)C(=O)CC[C@H]2CCOC2)cc1Cl 160029976 VFUIIQNUFCWYOE-NSHDSACASA-N 297.782 3.128 70 20 CGID Cc1nc2c(c(N[C@H]3CCO[C@H](C4CC4)C3)n1)CCCC2 160374958 YMIRJTOGIVDHGB-BBRMVZONSA-N 287.407 3.033 70 20 CGID C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCC2(CCC2)C1 160426431 QHLRBVXUKAHQHY-HUUCEWRRSA-N 294.439 3.167 70 20 CGID O=C(c1cc(F)cc(Cl)c1O)N1C[C@H]2CCC[C@H]2C1 159422272 CJWONRMOUHAVAL-DTORHVGOSA-N 283.730 3.057 70 20 CGID C[C@H](O)CN(C)[C@@H](C)c1cc(Cl)ccc1Cl 159456989 HBUNTEIHOBBZTD-IUCAKERBSA-N 262.180 3.367 70 20 CGID CS[C@H]1CCC[C@@H](NC(=O)CCCn2cccc2)C1 159588441 JEWNLXPMSJSRKS-KGLIPLIRSA-N 280.437 3.059 70 20 CGID Cc1c(C(=O)NCC(C)(C)N)oc2c1ccc1ccccc12 159980230 CSWAWDRUZJODHN-UHFFFAOYSA-N 296.370 3.362 70 20 CGID CCc1cc(O)nc(CN2CCC[C@H]2c2cccs2)n1 160549160 KPAHWNFCLSDQOI-LBPRGKRZSA-N 289.404 3.143 70 20 CGID CCCCCC(=O)N[C@H]1CCC[C@H]1NC(=O)CCCCC 217808731 XNHHKDWDOXHUNR-GASCZTMLSA-N 296.455 3.301 70 20 CGID CSc1ccc(C(=O)OCc2nc(C)sc2C)o1 161316749 JKBKDVIHSJUMNS-UHFFFAOYSA-N 283.374 3.432 70 20 CGID COCC(C)(C)c1nc(-c2ccc(C)c(F)c2)no1 161411446 SLDZYOYXWOWWLY-UHFFFAOYSA-N 264.300 3.108 70 20 CGID Cc1ccccc1C(=O)N[C@@H]1CCOC2(CCCC2)C1 160050024 UYKCZQMJRXYNSE-CQSZACIVSA-N 273.376 3.217 70 20 CGID CCC[C@@H](N[C@@H](CCO)CSC)c1ccccc1 160148421 RYUSPLYNNVEROO-LSDHHAIUSA-N 267.438 3.231 70 20 CGID Cc1cccc([C@@H]2CCCN2CCC(=O)OC(C)(C)C)n1 160256158 SDTDUJCOBRYXOF-HNNXBMFYSA-N 290.407 3.259 70 20 CGID Cc1nc2c(c(N[C@H]3CCO[C@@H](C4CC4)C3)n1)CCCC2 160375244 YMIRJTOGIVDHGB-XJKSGUPXSA-N 287.407 3.033 70 20 CGID CC(C)CCNC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 160416586 ACMRAUXGMAILDR-OAHLLOKOSA-N 292.379 3.022 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)C[C@@H](C)C1CCCCC1 160677363 ZGUHUCZJTVLPIH-CHWSQXEVSA-N 283.412 3.051 70 20 CGID CCc1sc(C(=O)N(C)Cc2cccn2C)cc1C 160755034 XJYNCODFTDRBNI-UHFFFAOYSA-N 276.405 3.230 70 20 CGID CCN(Cc1nccn1C)[C@H](C)c1cccc(OC)c1 160786993 GPRSDTHPHCVCDV-CYBMUJFWSA-N 273.380 3.012 70 20 CGID CC(C)[C@@H](NC(=O)[C@@H]1CCCNC1)c1ccccc1Cl 160830642 YSVKFKOYRANXON-IUODEOHRSA-N 294.826 3.153 70 20 CGID Cc1cccc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)n1 160877505 XBWZDEXLQGEUGT-AWEZNQCLSA-N 288.391 3.002 70 20 CGID CCOc1cc(C)ccc1N[C@H](C)CCn1cccn1 159416209 ZRWMPALXTLIXFL-CQSZACIVSA-N 273.380 3.481 70 20 CGID CCC(C)(CC)C(=O)NCC1(CN(C)C)CCCC1 159485604 XGQGINPOSRKVHY-UHFFFAOYSA-N 268.445 3.051 70 20 CGID C[C@H](NC(=O)NC1C[C@@H](C)O[C@H](C)C1)C1CCCCC1 159378120 UULFASNBJIQPRM-UPJWGTAASA-N 282.428 3.210 70 20 CGID O=C(Nc1ccccc1N1CCCCC1)[C@H]1CCCCO1 159566538 PLDUEPOPBXXQHN-MRXNPFEDSA-N 288.391 3.185 70 20 CGID CC1(C)C[C@@H](NCc2c[nH]nc2-c2cccs2)CCO1 160509963 WDIVTUVDHUWMRG-LBPRGKRZSA-N 291.420 3.185 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2cccnc2)n1 159791430 KCTAHZVAXFHAQA-INIZCTEOSA-N 253.349 3.122 70 20 CGID CCc1cccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1 161048074 WZLFAZOGOYLKGN-CVEARBPZSA-N 288.391 3.328 70 20 CGID CCC1(C(=O)N[C@H]2CCc3c(OC)cccc32)CCC1 160157954 AEIHKAQWQVMBNC-AWEZNQCLSA-N 273.376 3.379 70 20 CGID CC(C)CCN(C(=O)N[C@H]1CCO[C@@H](C2CC2)C1)C1CC1 160293098 SNOYSEIHOHPGNK-GOEBONIOSA-N 294.439 3.164 70 20 CGID CC(C)c1ccc(OCCN[C@H]2CCN(C)C[C@H]2C)cc1 160333361 JKUSHDYRQACIEL-QAPCUYQASA-N 290.451 3.119 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@@H]1CCCOc2ccccc21 160578100 KECYJUHXSHVDIJ-BMFZPTHFSA-N 275.392 3.041 70 20 CGID CC[C@@H](CC(=O)N[C@@H](CCO)C(C)C)c1ccccc1 160634101 DYABTMUALUFCAL-HOCLYGCPSA-N 277.408 3.094 70 20 CGID CC(C)(O)CN[C@H]1CCSc2c(Cl)cccc21 160647843 GQQOTQRYYRJUCI-NSHDSACASA-N 271.813 3.237 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(C)c(NC(C)=O)c1 159818733 FAXUQAUBSUEPQO-JTQLQIEISA-N 280.393 3.034 70 20 CGID Cc1nc2ccc(NC(=O)[C@@H]3CCCCO3)cc2s1 159669376 YTJGMEAVUOAZEW-LBPRGKRZSA-N 276.361 3.112 70 20 CGID C[C@@H](NC(=O)[C@@H]1CC1(C)C)c1cccc(-n2cccn2)c1 159488114 KRUGDMVBDYIQBM-DOMZBBRYSA-N 283.375 3.096 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccnn1[C@@H](C)C1CC1 159586813 UKBSHZQJKKTHNN-JVLSTEMRSA-N 261.369 3.229 70 20 CGID Cc1cc(C)c(C(=O)Nc2ccc3oc(C)nc3c2)[nH]1 159982612 AEAHWCIGJMCLNQ-UHFFFAOYSA-N 269.304 3.333 70 20 CGID CCCn1nccc1CNc1ccc(F)cc1OCC 160060493 QPSFEWDKEPGMGH-UHFFFAOYSA-N 277.343 3.443 70 20 CGID Cc1ccc(F)c(C(=O)N2CC=C(C(F)(F)F)CC2)c1 160578943 NBOGRFJUNNKIEG-UHFFFAOYSA-N 287.256 3.469 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cccs1 161033480 VMQUIDDPJVRNQL-XQQFMLRXSA-N 252.427 3.272 70 20 CGID COc1cc(NC(=O)c2ccc(F)cc2)ccc1F 160236025 TYPRKRWGDGHZKJ-UHFFFAOYSA-N 263.243 3.226 70 20 CGID CSC[C@](C)(O)CNCc1cccc2ccccc12 217867100 INFDIORLHNDVPM-MRXNPFEDSA-N 275.417 3.043 70 20 CGID Cc1nc(COC(=O)c2ccc(Cl)o2)c(C)s1 159425832 OMVFBRZEOJTILA-UHFFFAOYSA-N 271.725 3.363 70 20 CGID CC[C@H](C(=O)NCc1scnc1C)c1ccc(F)cc1 159808514 ULXOFWUCHZPMHU-ZDUSSCGKSA-N 292.379 3.401 70 20 CGID CC(C)CN(CC(C)C)C(=O)NCCc1cscn1 159456608 ZYUBMHGBUNVZJV-UHFFFAOYSA-N 283.441 3.009 70 20 CGID CCn1cc([C@H](C)NC[C@H](C)N2CCc3ccccc32)cn1 159924836 PYRBMQQHZQPAJL-GJZGRUSLSA-N 298.434 3.005 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(F)cc1F 159777277 VEOPPGOPMIQSLE-RNCFNFMXSA-N 253.292 3.273 70 20 CGID Cc1cccc(NC(=O)N(C)CCc2nccs2)c1 159717823 HTXJRJCZLASBFJ-UHFFFAOYSA-N 275.377 3.158 70 20 CGID CC[C@H](C)c1cc(C(=O)Nc2ccc(OC)c(N)c2)on1 161077500 PMNXZGKHCWHDLJ-VIFPVBQESA-N 289.335 3.031 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc2c1OCO2 161185062 GXHATAIXYWVWGU-TZMCWYRMSA-N 289.375 3.456 70 20 CGID COc1ccccc1CCNC(=O)c1ccc(C(C)C)nc1 160001300 FLHDIIFENUKURM-UHFFFAOYSA-N 298.386 3.186 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1nccs1 160031335 PGKKCHWCWOBDOR-IUCAKERBSA-N 264.375 3.255 70 20 CGID Cc1cc2c(NCCCC(=O)OC(C)C)ncnc2s1 160256663 JTZJQOXKADWUAA-UHFFFAOYSA-N 293.392 3.143 70 20 CGID CCc1cc(O)nc(CN[C@@H](C)c2ccc(Cl)cc2)n1 160541768 IRGWRTSRMRPDDB-JTQLQIEISA-N 291.782 3.249 70 20 CGID Cc1ccc(C)c([C@H](C)NCCNC(=O)c2ccccc2)c1 160710988 XJANPUWJHZPWKP-INIZCTEOSA-N 296.414 3.384 70 20 CGID CC(C)CSCCCNC(=O)c1cccc2[nH]cnc12 160738803 UIELGCSIKZDYMD-UHFFFAOYSA-N 291.420 3.072 70 20 CGID CC1=C(C(=O)NCC2(Cc3ccccc3)CC2)CCCO1 160787253 CUHLEKBDWWQKIY-UHFFFAOYSA-N 285.387 3.210 70 20 CGID C[C@H](NC(=O)Nc1ccccc1-n1cccn1)C1CCC1 160950813 UDGOEIPEAJUNHA-LBPRGKRZSA-N 284.363 3.182 70 20 CGID Cc1ccc(-c2nnc([C@@H](C)Nc3cc(C)n(C)n3)o2)cc1 159624455 RBEGMLDWPLXSGR-GFCCVEGCSA-N 297.362 3.260 70 20 CGID CCC[C@H](CCO)CNC(=O)c1cccc(Cl)c1F 159836124 QJVAYZPSOQNCSR-SNVBAGLBSA-N 287.762 3.008 70 20 CGID COc1cc(NC(=O)c2ccccc2F)ccc1F 160238147 CFMFJEOMDXLKJO-UHFFFAOYSA-N 263.243 3.226 70 20 CGID COc1ccc(NC(=O)c2ccc3c(c2)CCCC3)cc1N 161006217 PIGYQOJSUZRMDS-UHFFFAOYSA-N 296.370 3.409 70 20 CGID CCCCN(C(=O)[C@@H]1CCCNC1)[C@@H](C)c1ccccc1 161356061 OBMJBXNLNYGPIX-DOTOQJQBSA-N 288.435 3.376 70 20 CGID CC[C@H]1CCCC[C@H]1NC(=O)c1cccc(-c2ncn[nH]2)c1 160258192 WEDABHOVPYDMLR-SWLSCSKDSA-N 298.390 3.170 70 20 CGID O=S(=O)(Cc1ccccc1)N1CCC2(CCCC2)CC1 160588753 FEXVKQFCKNSURI-UHFFFAOYSA-N 293.432 3.173 70 20 CGID CN(Cc1cccn1C)C(=O)c1cc(F)c(F)cc1Cl 160743728 NYJVUXTWQWMHKE-UHFFFAOYSA-N 298.720 3.229 70 20 CGID Cc1c(C(=O)NCC2CCC(C)CC2)cnn1CC(C)C 160897216 SHMGWLYDHYGTFJ-UHFFFAOYSA-N 291.439 3.404 70 20 CGID Cc1cc(Oc2ccc(NC(=O)C(C)(C)F)cc2)n[nH]1 159903924 BDEXURFICFXPHL-UHFFFAOYSA-N 277.299 3.197 70 20 CGID OCCN[C@@H](Cc1ccc(F)cc1)c1ccccc1Cl 159716621 YUYLHZAZPKFSTB-INIZCTEOSA-N 293.769 3.345 70 20 CGID CC(C)(C)c1ncc(C(=O)NCC2(C3CC3)CC2)s1 159725017 NOTOJNAARTUPBD-UHFFFAOYSA-N 278.421 3.361 70 20 CGID CC(C)Cc1noc(CN2CC[C@@H]3CCCC[C@@H]32)n1 159582113 WBBCNWOGKCZEED-STQMWFEESA-N 263.385 3.033 70 20 CGID CCCn1nccc1CN[C@@H](C)c1c(F)cccc1F 160095169 XBLLFMOUIUUCGR-NSHDSACASA-N 279.334 3.422 70 20 CGID Cc1cccc(N(C)C(=O)Cc2nc(C)sc2C)c1 161242982 JWCPAFZNPVQCGG-UHFFFAOYSA-N 274.389 3.274 70 20 CGID CC(C)(C)c1nsc(Sc2ccncc2)n1 160038439 AHIMAIWNDXGFGT-UHFFFAOYSA-N 251.380 3.382 70 20 CGID CC(C)C[C@@H](C)CC(=O)N(C)c1ccc2c(c1)OCO2 160221635 JAAMMNYTBOZXQQ-GFCCVEGCSA-N 277.364 3.450 70 20 CGID CCCCCOCC(=O)N[C@H]1CCCc2sccc21 160289694 PEKXOWBBNFQBRC-ZDUSSCGKSA-N 281.421 3.449 70 20 CGID CC(C)(C)c1nsc(NCC[C@H]2CCCCO2)n1 160308564 KWJAKIIFYGGUEQ-SNVBAGLBSA-N 269.414 3.207 70 20 CGID c1ccc2nc(N3CCC[C@H]3CN3CCCCC3)cnc2c1 160437363 AKGRDDODWUYIGO-HNNXBMFYSA-N 296.418 3.085 70 20 CGID CCCCCN(Cc1ccc(F)cc1)Cc1nncn1C 160762869 HGOKZLKFDIZMOW-UHFFFAOYSA-N 290.386 3.147 70 20 CGID CC[C@@H](NCCCc1cnn(C)c1)c1ccc(F)cc1F 160868199 CKPMVUVEQXOOEV-MRXNPFEDSA-N 293.361 3.372 70 20 CGID C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C)[C@@H](C)C1 160873987 AGRZORREFNATIS-IHRRRGAJSA-N 290.407 3.011 70 20 CGID C[C@H](NC(=O)c1ccc(CN)cc1)[C@@H](C)c1ccccc1 160891894 DOSNZMNVYZZPQH-KGLIPLIRSA-N 282.387 3.067 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)CC(C)(C)C)n1 160987122 GSUKQHZDXASKCF-UHFFFAOYSA-N 286.379 3.409 70 20 CGID C[C@H](NCCO)c1ccc2ccccc2c1OC(F)F 159678787 MMGJIRXPHXPFSC-JTQLQIEISA-N 281.302 3.084 70 20 CGID Cc1cccc(C(=O)N(C)CCOCc2ccccc2)c1 159489016 QGPHGQQEKBVBTA-UHFFFAOYSA-N 283.371 3.284 70 20 CGID CCOC(=O)c1cccc(N(CC)Cc2ccccn2)c1 159501866 JFDDHWWJDXAGGF-UHFFFAOYSA-N 284.359 3.285 70 20 CGID CC(=O)C[C@@H](C)NC(=O)c1oc2c(C)ccc(C)c2c1C 159955571 WOAKGSGCCJNCFJ-LLVKDONJSA-N 287.359 3.455 70 20 CGID CCCn1ncc(C(=O)Nc2cccc(C)c2O)c1C1CC1 159391596 SBBYZXCHJQBLDZ-UHFFFAOYSA-N 299.374 3.437 70 20 CGID COc1ccc(CCNc2ccnc(C)c2)cc1OC 160912736 SHVHOZVGROJLQT-UHFFFAOYSA-N 272.348 3.062 70 20 CGID C[C@H](NC[C@H](C)N(C)Cc1ccccc1)c1cncs1 160862018 DRPAJBUKHALZNH-KBPBESRZSA-N 289.448 3.314 70 20 CGID CN(Cc1ccc(C(C)(C)C)cc1)C(=O)C(F)F 217595050 ZDQYYTPLDWQUNT-UHFFFAOYSA-N 255.308 3.208 70 20 CGID Cc1cccc(C(=O)Nc2[nH]nc(-c3ccc(C)o3)c2C)n1 161359396 TXAHNCYZVBXEPZ-UHFFFAOYSA-N 296.330 3.242 70 20 CGID COc1c(F)cc(NC(=O)N[C@@H](C)C2CCC2)cc1F 161466750 YVADQLBTCYTBRZ-QMMMGPOBSA-N 284.306 3.284 70 20 CGID COCCC1(C(=O)N[C@H]2CCCc3sccc32)CCC1 160157277 ILADVLZBUZMYRN-ZDUSSCGKSA-N 293.432 3.449 70 20 CGID Cc1cnc(NC[C@](C)(O)c2ccccc2Cl)nc1C 160180349 ZUDZSQJEBADJIM-HNNXBMFYSA-N 291.782 3.066 70 20 CGID Cc1cnc(C)c(NC[C@@](C)(O)c2ccccc2Cl)n1 160186062 WBYREUWYQQDQAR-OAHLLOKOSA-N 291.782 3.066 70 20 CGID CC(=O)N1CCC[C@@H]1c1c(C)nn(CC(C)C)c1Cl 160321262 XWCOHHLCCUEVIG-GFCCVEGCSA-N 283.803 3.184 70 20 CGID O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1ccc(O)c(Cl)c1 160616492 PKFMUGADDIZREN-VBNZEHGJSA-N 299.757 3.114 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](C)C2(C)CC2)c1 160627253 ASBOKYUUNXSGFY-CYBMUJFWSA-N 274.408 3.105 70 20 CGID CCc1nsc(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160679467 CIOAMJANJBGFFQ-STQMWFEESA-N 289.404 3.433 70 20 CGID C[C@H]1CCCN(C(=O)c2cc(F)c(Cl)cc2F)C1 160964848 UOQVRBJMKRCJPF-QMMMGPOBSA-N 273.710 3.490 70 20 CGID CCCC(=O)Nc1cccc(CN[C@@H](C)c2cnccn2)c1 159897202 NDQIOTODHJQTMQ-ZDUSSCGKSA-N 298.390 3.066 70 20 CGID CCN(C(=O)CCc1ccc(F)cc1F)C(C)C 159906218 HGUXUCHZMDSPJF-UHFFFAOYSA-N 255.308 3.154 70 20 CGID Cc1cccc([C@@H](C)SCCN2CCOCC2)c1 159769315 QBZPEWXZXWTVPN-CQSZACIVSA-N 265.422 3.121 70 20 CGID CCCn1nccc1CNc1ccccc1COC 160011258 RITFFSREYNPHQP-UHFFFAOYSA-N 259.353 3.052 70 20 CGID CC(C)CCOCCCCCCS(=O)(=O)Cl 112155126 QTJYSTUQWFYCKR-UHFFFAOYSA-N 270.822 3.178 70 20 CGID C[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1ccccc1F 218434939 CFBCPQNNGJMMTR-DVOMOZLQSA-N 265.372 3.275 70 20 CGID CN(C)[C@H]1CCC[C@H](N[C@@H]2CCc3cc(F)ccc32)C1 161003014 VXGODTAGULUNAT-YQQAZPJKSA-N 276.399 3.275 70 20 CGID CC[C@H](NC(=O)Nc1ccc(SC)cc1)[C@H]1CCCO1 160117225 VWZKCDMMFLLDKS-UONOGXRCSA-N 294.420 3.488 70 20 CGID FC(F)(F)c1ccnc(N[C@@H]2CCO[C@@H](C3CC3)C2)c1 160332666 AISKDABCEULTFS-VXGBXAGGSA-N 286.297 3.470 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1C[C@H]1c1cccnc1 160478507 KPSJMDVZOOXQJC-RRFJBIMHSA-N 298.411 3.440 70 20 CGID C[C@@H](CC(=O)NCC1(C)CCCC1)c1ccncc1 160500958 ZFXYXRXQVUUBTG-ZDUSSCGKSA-N 260.381 3.272 70 20 CGID Cc1ccccc1NC(=O)N[C@H]1[C@H]2CCO[C@@H]2C12CCC2 160657783 KVOMNYLNNFXBBN-SNPRPXQTSA-N 286.375 3.074 70 20 CGID CC(C)[C@H]1CN(C(=O)C[C@@H](C)c2ccncc2)CCS1 160826775 PQRAACXXKVJKEW-UKRRQHHQSA-N 292.448 3.175 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)C[C@@H]1C=CCC1 160870925 OYPFQNNVKLYRKY-VXGBXAGGSA-N 277.389 3.182 70 20 CGID CC1(NC(=O)N[C@@H]2CCc3ccc(F)cc32)CCC1 160918157 GWTSVRJAQOMCOX-CYBMUJFWSA-N 262.328 3.055 70 20 CGID CC[C@H](C)[C@H](NCc1cccnc1C)C(=O)OC(C)(C)C 160952122 JDUXNFWACYQVFW-WFASDCNBSA-N 292.423 3.236 70 20 CGID COc1c(Cl)cccc1NC(=O)C[C@@H](C)SC 160952337 REUZMKPRUHOOEG-MRVPVSSYSA-N 273.785 3.429 70 20 CGID CCOCCC1(CNC(=O)C[C@H](C)CC(C)C)CC1 159419090 GRDLFUVQJVZWPH-CQSZACIVSA-N 269.429 3.382 70 20 CGID CO[C@H](C)CC(=O)N1C[C@H](C)CSc2ccccc21 159633816 JLNXWZQEBNQATE-NWDGAFQWSA-N 279.405 3.186 70 20 CGID COc1ccc(C)c2c1N(Cc1ccncc1)CCC2 159673109 ODLRPKCDSVWGRG-UHFFFAOYSA-N 268.360 3.351 70 20 CGID CCC(C)(CC)C(=O)NCCC[C@H]1CCCCO1 159487878 DYPAYIVWZYMPJG-CYBMUJFWSA-N 255.402 3.278 70 20 CGID CC(C)CNC(=O)CNC1CCC(c2ccccc2)CC1 159368228 XVQLEIAEEUSDDN-UHFFFAOYSA-N 288.435 3.075 70 20 CGID Cc1cnccc1NC(=O)Cc1csc(-c2ccoc2)n1 159389437 ALXNOWTYQNRSJU-UHFFFAOYSA-N 299.355 3.288 70 20 CGID Cc1cc(C)cc(NC(=O)N(C)[C@H]2CCSC2)c1 159397364 UJMWSPAPGIKPAT-ZDUSSCGKSA-N 264.394 3.273 70 20 CGID CC[C@H](C)[C@@H](NCc1ccc(Cl)cc1F)C(=O)OC 160743439 XRGFSGGSZJGCEB-TVQRCGJNSA-N 287.762 3.156 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cccs1 161033881 VMQUIDDPJVRNQL-AGIUHOORSA-N 252.427 3.272 70 20 CGID CCN(CC)CCNC(=O)Nc1ccc(C(C)(C)C)cc1 217301265 PYDNQIQIOWJSLL-UHFFFAOYSA-N 291.439 3.447 70 20 CGID CCS[C@@H]1CCC[C@H]1Nc1ncnc(CC)c1F 218056935 HTAKGPFUAMBXDF-GHMZBOCLSA-N 269.389 3.264 70 20 CGID O=C(C=C1CCCCC1)Nc1cccc(S(=O)(=O)F)c1 809281463 YFAMFYZQQILZOM-UHFFFAOYSA-N 297.351 3.174 70 20 CGID c1ccc2oc(CN[C@H]3CCN4CCCC[C@@H]34)cc2c1 217631640 KLWNHHHVIAAOIX-HOTGVXAUSA-N 270.376 3.149 70 20 CGID CC(C)N(CCSCc1cccc(C(N)=O)c1)C(C)C 161051765 UQNVQWJMTZTKGS-UHFFFAOYSA-N 294.464 3.138 70 20 CGID Nc1ccc2c(N[C@H]3CCCc4sccc43)ncnc2n1 161062369 BTLZYWWKTCXLLZ-NSHDSACASA-N 297.387 3.158 70 20 CGID CCOCCC1(C(=O)N[C@@H]2CCc3ccccc32)CCC1 161235745 KIHBEBWJEOXWSE-MRXNPFEDSA-N 287.403 3.387 70 20 CGID Cc1cc2cc(C(=O)N[C@H]3CCC[C@@H](N)C3)oc2cc1C 161447856 ZXNLHVKIXXBZPE-KGLIPLIRSA-N 286.375 3.049 70 20 CGID CCCc1ccc(C(=O)NCCc2cccc(O)c2)cc1 160224419 NQISIUWXACBAFG-UHFFFAOYSA-N 283.371 3.317 70 20 CGID Cc1cc(C(=O)NC2CC(C)C2)ccc1Br 160266926 RHIXCFGJPWDZCF-UHFFFAOYSA-N 282.181 3.286 70 20 CGID CSC[C@H](CCO)N[C@H](Cc1ccc(C)cc1)C1CC1 160437105 OZZNLYZFYZSTSM-DLBZAZTESA-N 293.476 3.020 70 20 CGID CCCCN(C)C(=O)Cc1cccc(OC(F)(F)F)c1 160592317 INRNKNWWSHLZKS-UHFFFAOYSA-N 289.297 3.386 70 20 CGID CCc1cc(O)nc(CN(C)[C@H](C)c2ccccc2F)n1 160902920 ZGOHYZYUAUQOAP-LLVKDONJSA-N 289.354 3.077 70 20 CGID CC[C@@H](OC1CCCCC1)C(=O)Nc1ccncc1 159607644 SWPKVPIGKWNPRM-CQSZACIVSA-N 262.353 3.148 70 20 CGID CC(C)CN(Cc1cnc2ccccn12)CC(F)(F)F 159864836 ZYCWWNXIGYQUPO-UHFFFAOYSA-N 285.313 3.355 70 20 CGID CC[C@@H]1CN(C(=O)Nc2ccnc(C)c2Cl)CCS1 159511543 FGKKVLCCKLDJTJ-SNVBAGLBSA-N 299.827 3.403 70 20 CGID CCc1cc(O)nc(CN(C)Cc2ccc(Cl)s2)n1 160552461 PDZNVOLQHPKXOH-UHFFFAOYSA-N 297.811 3.092 70 20 CGID CCOC(=O)[C@H](c1ccccc1)N(C)Cc1ccoc1 218170998 XEEDUMZEFZMUKA-HNNXBMFYSA-N 273.332 3.016 70 20 CGID CC[C@H](C)N(C)CCNCc1cc(Cl)ccc1OC 217397483 DZHABVVDBWHNBX-LBPRGKRZSA-N 284.831 3.169 70 20 CGID O=C([C@@H]1CC[C@@H]2CCCC[C@@H]2C1)N1CCOCC12CCC2 161189074 RMNHFLKGVDIKSN-ARFHVFGLSA-N 291.435 3.374 70 20 CGID CC[C@H](SCCC(N)=O)c1ccc(F)cc1F 161368151 JZUSNLOHHITOKP-NSHDSACASA-N 259.321 3.025 70 20 CGID Cc1ccc2cc(C(=O)N[C@H](C)C[C@H]3CCCO3)ccc2n1 161411019 PRRBSIGBBCHKNI-CZUORRHYSA-N 298.386 3.231 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCCOc2ccc(F)cc21 160075238 DFWVKTFKALBEPO-XJKSGUPXSA-N 294.414 3.359 70 20 CGID CC(C)C[C@@H](NC(=O)[C@H]1CCCCO1)c1ccccc1 160103794 NRNXHPAGFNOSEZ-HZPDHXFCSA-N 275.392 3.459 70 20 CGID CC[C@@H](CN[C@@H](C)c1cnccn1)Oc1ccccc1F 160315825 VRFRAQIAKUBHER-STQMWFEESA-N 289.354 3.124 70 20 CGID CC(C)c1ccc(OCCN[C@@H]2CCN(C)[C@@H](C)C2)cc1 160326352 IRCIGAFNDRJOBH-DOTOQJQBSA-N 290.451 3.261 70 20 CGID CCC(CC)CC(=O)N(C)c1ccc2c(c1)OCO2 160400528 JGXOJZJEYMAPMW-UHFFFAOYSA-N 263.337 3.204 70 20 CGID O=C(CCC1CCCC1)Cn1cnc(C2CCC2)cc1=O 160490131 KOXQWOFUYFYZCA-UHFFFAOYSA-N 288.391 3.050 70 20 CGID Cc1cc(Oc2ccc(NC(=O)[C@H](C)C3CC3)cc2)n[nH]1 160506936 AWSIVKOFKNBSFC-LLVKDONJSA-N 285.347 3.495 70 20 CGID CCC(=O)c1cccc(NC(=O)c2[nH]nc3c2CCCC3)c1 160740004 VMALZKSYMHVWBA-UHFFFAOYSA-N 297.358 3.134 70 20 CGID C[C@@H](N[C@H]1CCCSC1)c1ccc(F)cc1N(C)C 159623066 LIWNNUSKPUBIRU-YPMHNXCESA-N 282.428 3.438 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCc1ccco1 159690697 YROHLFKUKIONKG-QWHCGFSZSA-N 275.373 3.112 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2NC(=O)c1ccc(Cl)o1 159366938 BXKWKZAKMUWGIJ-GFCCVEGCSA-N 290.750 3.323 70 20 CGID CCC[C@@H](CCO)CNC(=O)c1cc(C)cc(Cl)c1 159834364 DZRSZQPBPPINNV-LBPRGKRZSA-N 283.799 3.177 70 20 CGID OCC1(CNC2CC(c3cccc(F)c3)C2)CCCC1 160122672 SLDJUGQRSLZWRB-UHFFFAOYSA-N 277.383 3.214 70 20 CGID COc1cc(NCc2c(C)nn(C)c2Cl)ccc1F 160260528 UTUGZLNCZCCVAO-UHFFFAOYSA-N 283.734 3.142 70 20 CGID Nc1ccccc1Cc1nc([C@@H]2CCCCS2)no1 160655230 AYOQFGFWKWMOCX-LBPRGKRZSA-N 275.377 3.201 70 20 CGID Cc1cccc([C@@H]2CCCN2CCOCC(F)(F)F)n1 160420390 CDONEUNQUWDHOB-ZDUSSCGKSA-N 288.313 3.106 70 20 CGID CC(C)C[C@@H](C)NC(=O)NC[C@]1(C)CCCS1 160277241 IEEMDGCYPIVBMG-YPMHNXCESA-N 258.431 3.006 70 20 CGID C[C@H]1CCCCN1C(=O)[C@H](C)c1c(F)cccc1F 161149502 BXCXINRIBWGVLP-WDEREUQCSA-N 267.319 3.469 70 20 CGID C[C@H]1CC[C@H](C)N1c1ncnc2c1cnn2-c1ccccc1 161443205 PQTKGBCTPMZGIN-STQMWFEESA-N 293.374 3.193 70 20 CGID CCO[C@H](CC)C(=O)N1CCc2c(Cl)cccc21 161476632 AJJDLNCHXNTCNU-CYBMUJFWSA-N 267.756 3.044 70 20 CGID CN(C(=O)c1cc2ccccc2o1)c1ccc2c(c1)OCO2 160284025 OZIWPQNDRRDXOJ-UHFFFAOYSA-N 295.294 3.438 70 20 CGID COC(CN(Cc1cccs1)Cc1cccs1)OC 160344432 XALNUJPNACMVGW-UHFFFAOYSA-N 297.445 3.431 70 20 CGID CC(C)(C)c1ccc(=O)n(CC(=O)CCC2CCCC2)n1 160385777 HFSHFJMCFQDLAZ-UHFFFAOYSA-N 290.407 3.080 70 20 CGID Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cc(C)c(C)cc1C)CC2 160555870 FCJZLQSKWLULOW-ZBFHGGJFSA-N 298.434 3.177 70 20 CGID CC(=O)Nc1ccc(C)c(N[C@H](C)C(=O)OC(C)(C)C)c1 160749698 MXPYYUXQGSYZAR-LLVKDONJSA-N 292.379 3.096 70 20 CGID Cc1ccc(CSCCCCS(C)(=O)=O)cc1 160901671 UPEPNHNNDQJDDA-UHFFFAOYSA-N 272.435 3.053 70 20 CGID O=C(Nc1ncc(Cl)s1)[C@@H]1OCCc2ccccc21 160995135 BPYUFAXKYNJLIX-LLVKDONJSA-N 294.763 3.049 70 20 CGID CCCCCn1ccc2cc(OC)c(F)cc2c1=O 159871084 RLBIBMMNMYIVGU-UHFFFAOYSA-N 263.312 3.339 70 20 CGID O=C(NC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1ccc(F)c(F)c1 159955981 YCKKNGGGRYQKKH-VBQJREDUSA-N 299.320 3.281 70 20 CGID Cc1nccc(NC(=O)N2CCC[C@H](C)C2)c1Cl 159787453 CKYOEHKRSTWSMO-VIFPVBQESA-N 267.760 3.307 70 20 CGID CO[C@H]1CCC[C@H](NCc2cccc3cccnc23)C1 159435775 YVDCCJKIBQXXMM-HOTGVXAUSA-N 270.376 3.282 70 20 CGID COc1cc(NC2Cc3ccccc3C2)ccc1F 159946449 YOIWOMCUXMOMNM-UHFFFAOYSA-N 257.308 3.414 70 20 CGID CC(C)(C)C(=O)CNC(=O)c1cc2ccc(F)cc2s1 161163800 DGZOFAMCNNWCSU-UHFFFAOYSA-N 293.363 3.385 70 20 CGID CCS[C@H]1CCC[C@H]1Nc1ncnc(CC)c1F 218057001 HTAKGPFUAMBXDF-MNOVXSKESA-N 269.389 3.264 70 20 CGID Cc1cccc([C@@H]2CCCN2CCOC(C)(C)C)n1 159842079 IZPDSJBKULLAGD-HNNXBMFYSA-N 262.397 3.342 70 20 CGID Fc1cc(NCc2nnc3n2CCCC3)ccc1Cl 217318453 KDSZKPMMEWFYLB-UHFFFAOYSA-N 280.734 3.019 70 20 CGID Cc1cc(NC(=O)[C@@H](C)Cc2ccc(Cl)cc2)nn1C 161171546 AOSPHERKCLHKMI-JTQLQIEISA-N 291.782 3.199 70 20 CGID CCCC[C@@H](CC)CNC1CCC(NC(C)=O)CC1 161215809 UNZGYYWYGIAOQX-QQFBHYJXSA-N 268.445 3.240 70 20 CGID C[C@@H](NC(=O)COc1ccc2[nH]ccc2c1)c1ccccc1 160044436 GEBWTCCSHSPGPA-CYBMUJFWSA-N 294.354 3.424 70 20 CGID Cc1ccc(CNc2cccc(C(=O)N3CCCC3)c2)o1 160065254 IFCJSBNHCSFCJL-UHFFFAOYSA-N 284.359 3.436 70 20 CGID Cc1cccc(CC(=O)N[C@H]2CCOC3(CCCC3)C2)c1 160204244 PBUDZPXPKFJCSO-INIZCTEOSA-N 287.403 3.146 70 20 CGID C[C@H](Oc1cccc(Cl)c1)C(=O)NCC1(C2CC2)CC1 160228618 LKEVVZFMGCHREC-NSHDSACASA-N 293.794 3.414 70 20 CGID CN(CCC1CC1)C(=O)Nc1cccc(OCCF)c1 160289987 DDWOOWJVWMIFBR-UHFFFAOYSA-N 280.343 3.299 70 20 CGID Cc1ccc(C(=O)CCN2CC[C@@H]3OCCC[C@@H]3C2)cc1 160321876 OSYREHNPGAIGSV-AEFFLSMTSA-N 287.403 3.069 70 20 CGID CN(CCCn1ccnc1)C(=O)CCCSC(C)(C)C 160479684 ZUJGCKYTLGRSKP-UHFFFAOYSA-N 297.468 3.044 70 20 CGID CCc1cc(C)c(C(=O)NC[C@H]2CCCN2CC(C)C)o1 160517931 GLSQLGZNLZDZPM-CQSZACIVSA-N 292.423 3.001 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)c2cccs2)n1 160881275 XBUFKXABYOTYFB-UHFFFAOYSA-N 298.371 3.348 70 20 CGID CC(C)(C)c1nsc(N[C@H]2CCC[C@@H]3OCC[C@H]23)n1 159977178 HWWYKFOTAPBLGW-VWYCJHECSA-N 281.425 3.205 70 20 CGID CC1(C)C[C@@H]1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 159598133 HXFIFHVXRJLYPE-BMFZPTHFSA-N 287.403 3.317 70 20 CGID Cc1ncccc1CNC(C)(C)CN(C)Cc1ccccc1 159379538 BAYOESYSVQZCBD-UHFFFAOYSA-N 297.446 3.390 70 20 CGID O=C(OCCC1CC1)c1ccc(Cl)nc1Cl 217735591 KLLKMWIYFKDOLF-UHFFFAOYSA-N 260.120 3.345 70 20 CGID COC(=O)c1csc(NC(=O)NCC2(C(C)C)CC2)c1 161095166 APJMPGVPVWYZLR-UHFFFAOYSA-N 296.392 3.092 70 20 CGID C[C@@H](Oc1cccc(Cl)c1)C(=O)NCC1(C2CC2)CC1 160228747 LKEVVZFMGCHREC-LLVKDONJSA-N 293.794 3.414 70 20 CGID Cc1ccc(-c2nnc(NC(=O)[C@@H]3CCC[C@H](C)C3)[nH]2)o1 160258867 IIVOVBDLPULBPL-GXSJLCMTSA-N 288.351 3.138 70 20 CGID C[C@H](CC(=O)N(C)C(C1CC1)C1CC1)c1ccncc1 160285029 QILOBJXSRCAAFQ-GFCCVEGCSA-N 272.392 3.222 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCC1(c2ccccc2)CC1 160414583 SQRXNLNSDQYJON-GDBMZVCRSA-N 257.377 3.271 70 20 CGID c1ccn2c(CN3CCC4(CCCCC4)C3)cnc2c1 160627269 WQODGMMXMYSAQV-UHFFFAOYSA-N 269.392 3.491 70 20 CGID CC(C)[C@@H](CCO)NC(=O)CCc1ccc2ccccc2c1 160720445 KTUZAVCZBTWVBO-GOSISDBHSA-N 299.414 3.296 70 20 CGID Cc1cc(-c2nc(C3CCOCC3)no2)cc(C)c1F 160869936 CHSAEKFIPLWQAA-UHFFFAOYSA-N 276.311 3.387 70 20 CGID CCOc1ccc([C@H](C)N[C@@H](C)[C@@H]2CCOC2)cc1OC 159946069 CBCAGXTXMOBTMI-KCQAQPDRSA-N 293.407 3.170 70 20 CGID CC(C)CCCNCc1cncc(Br)c1 160564861 LBLKOFZJOYUYGS-UHFFFAOYSA-N 271.202 3.370 70 20 CGID OCCN(Cc1ccccc1)Cc1cc(Cl)ccc1F 218312661 BMDKJXIALHAJPH-UHFFFAOYSA-N 293.769 3.474 70 20 CGID C[C@H]1OCCN(C(=O)CCC(C)(C)c2ccccc2)[C@@H]1C 160046877 QFMMCESFLKQYSS-HUUCEWRRSA-N 289.419 3.380 70 20 CGID CCCCn1ncc(C(=O)N(C)c2ccccc2)c1C 160060514 DWPGTXDLUWYWGA-UHFFFAOYSA-N 271.364 3.268 70 20 CGID CC1(C)CCCN(C(=O)N[C@H]2CCO[C@@H](C3CC3)C2)CC1 160302128 SFAAEFFJIJQRMS-LSDHHAIUSA-N 294.439 3.166 70 20 CGID COc1ccc(NC(=O)c2cc(F)c(Cl)cc2F)cn1 160375501 MYJRTBINGKHZNN-UHFFFAOYSA-N 298.676 3.274 70 20 CGID CC[C@H](NC(=O)CC[C@@H]1CC[C@H](C)O1)c1c(C)noc1C 160418682 YQCSJXKPTPHURB-BPNCWPANSA-N 294.395 3.206 70 20 CGID Cc1cc([C@H](C)NC(=O)N(C)CC2CCOCC2)c(C)o1 160443918 LMMYCOXJMOFMER-LBPRGKRZSA-N 294.395 3.025 70 20 CGID Cc1cc(Oc2ccc(NC(=O)CC3CC3)cc2)n[nH]1 160444102 FQZDQGSHCCPTAF-UHFFFAOYSA-N 271.320 3.249 70 20 CGID COC[C@@H](NCC1(Sc2ccccc2)CC1)C1CC1 160510230 UQAUZAZMCKYLPA-OAHLLOKOSA-N 277.433 3.326 70 20 CGID CCc1cnc(CN(C)c2nc(C(C)(C)C)ns2)s1 159814108 KBGFFMSNPGKRHN-UHFFFAOYSA-N 296.465 3.491 70 20 CGID CC[C@@H](NCCOc1ccc(Cl)cc1)[C@@H]1CCOC1 159640610 ICGRTQACGUZEDM-IUODEOHRSA-N 283.799 3.124 70 20 CGID Cc1ccc(CNC(=O)NCC2CCC(C)(C)CC2)cn1 159865832 GGLIJTCLIIFURL-UHFFFAOYSA-N 289.423 3.406 70 20 CGID CC(C)(C)c1nsc(N2C[C@H]3CCCC[C@H]3C2)n1 159868750 QUZCDFLXNYUWBF-PHIMTYICSA-N 265.426 3.462 70 20 CGID Cc1ccc(NC(=O)N(C)CCc2nccs2)c(C)c1 159734014 GJVXSIVMXBWITO-UHFFFAOYSA-N 289.404 3.466 70 20 CGID CCS[C@@H]1CCC[C@@H]1NC(=O)CCCn1cccc1 159797481 GNQLVWAZVWGZJF-UONOGXRCSA-N 280.437 3.059 70 20 CGID CC(C)c1nc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cs1 159553730 ZNQKKUAJOGHBOM-MCIONIFRSA-N 292.448 3.314 70 20 CGID CC[C@@H](C)N(C)CCNCc1ccc(OC(F)F)cc1 217384275 YKGHCMVTRQWCJG-GFCCVEGCSA-N 286.366 3.108 70 20 CGID COc1ccc([C@@H](NC(=O)NC(C)C)C(F)(F)F)cc1 161499615 HVADAOYBQVNZNW-LLVKDONJSA-N 290.285 3.006 70 20 CGID CCCOc1ccc(CNC(=O)C[C@H](C)SC)cc1 160004952 XIYLKSHDMCQTPL-LBPRGKRZSA-N 281.421 3.233 70 20 CGID CCCCN(CC)C(=O)COc1ccc(SC)cc1 160478281 FILWIGXBXAPQCS-UHFFFAOYSA-N 281.421 3.436 70 20 CGID C[C@@H](c1nc(C2CC2)no1)c1c(F)cccc1F 160819824 FZXRRKCYSUQKKX-SSDOTTSWSA-N 250.248 3.377 70 20 CGID CCOCCC1(CNC(=O)N[C@H]2CCCC2(C)C)CC1 159461197 OFNTVQULSFDVAC-ZDUSSCGKSA-N 282.428 3.071 70 20 CGID CCOc1ccc([C@H](C)N[C@H](CC)COC)cc1OC 159975068 HZEZJPUVOLJNFB-GXTWGEPZSA-N 281.396 3.170 70 20 CGID CC[C@@H]1CN(C(=O)[C@@H](C)Cc2ccccc2F)C[C@@H](C)O1 159781552 IYPAMVJAGORJSR-GZBFAFLISA-N 293.382 3.030 70 20 CGID CN(Cc1ccc(O)cc1)c1nc(C(C)(C)C)ns1 160149343 FNCXTENDXNMCDT-UHFFFAOYSA-N 277.393 3.178 70 20 CGID Cc1ccc(CCC2CCN(C(=O)N(C)C)CC2)cc1 217400957 LZNLLBCTXDJZNH-UHFFFAOYSA-N 274.408 3.321 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1ncoc1C 161191446 PDVRNFOXGKMMLC-VXGBXAGGSA-N 250.342 3.024 70 20 CGID Cc1cnccc1CCNC(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C 161214723 ICDYNLCOFBIQTJ-DVOMOZLQSA-N 289.423 3.056 70 20 CGID CCc1ccc(O)c(NC(=O)CC2CCSCC2)c1 161487404 GSNCCQCRPGCXFZ-UHFFFAOYSA-N 279.405 3.426 70 20 CGID COCCCCC(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C 161487470 DVVNKEZZEBMCPY-UHFFFAOYSA-N 291.351 3.042 70 20 CGID O=C(NCCc1ccc(-c2ccccc2)cc1)[C@@H]1CCOC1 160039192 DZQFZDXKWAFWJG-GOSISDBHSA-N 295.382 3.049 70 20 CGID O=C(N[C@@H]1C=CCCC1)c1cc(F)cc(Cl)c1O 160381655 JHSLYXYZDKVWIY-SECBINFHSA-N 269.703 3.023 70 20 CGID CC1(C)C[C@H](NCc2csc(-c3ccco3)n2)CCO1 160434686 NPEJGFBNWODNJS-LLVKDONJSA-N 292.404 3.450 70 20 CGID C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C1CCC(C)(C)CC1 160654558 JMPJPUMRWDLBRD-HIFRSBDPSA-N 280.456 3.001 70 20 CGID N[C@H]1CCC[C@H](NC(=O)CCc2ccc3ccccc3c2)C1 160856045 FRGOCIIGAZHECP-ROUUACIJSA-N 296.414 3.159 70 20 CGID Cn1cnnc1CSCc1cccc(Br)c1 160932921 ZFXCPLPTWVMREQ-UHFFFAOYSA-N 298.209 3.011 70 20 CGID CCCCCC[C@@H](C)NC(=O)NOCc1cccnc1 160988134 GLYIQGXDDJSTQT-CYBMUJFWSA-N 279.384 3.171 70 20 CGID CCOC(=O)c1sc(NC(=O)[C@@H]2C[C@@]2(C)CC)nc1C 159437522 BSWSOSOYWCIHJB-LKFCYVNXSA-N 296.392 3.003 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)Cc1cn(C)c2ccccc12 159637524 AYSRJMNMWAUBCE-XJKSGUPXSA-N 284.403 3.416 70 20 CGID Cc1oc(C)c(C(=O)N[C@H]2CCOC3(CCCC3)C2)c1C 159847459 XMTNUGHMAUVNID-AWEZNQCLSA-N 291.391 3.426 70 20 CGID CCO[C@@H](C)c1noc(CN[C@H](C)c2ccccc2C)n1 159699367 DZYOXCVHYKXOMX-OLZOCXBDSA-N 289.379 3.326 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)cc1 159919963 BHHHEZHMTCTKAJ-OAHLLOKOSA-N 273.376 3.217 70 20 CGID Cc1ccc(C)c([C@@H](C)N(C)C(=O)CC2CCNCC2)c1 159967173 BHRJGAHXTAPZKH-OAHLLOKOSA-N 288.435 3.213 70 20 CGID C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc2[nH]cnc12 159575787 LZIOJLVRMWRYBZ-JMSVASOKSA-N 283.375 3.356 70 20 CGID C[C@H](CNc1nc(C(C)(C)C)ns1)CC1(C)OCCO1 159594044 VOODBTGYWJNLGP-JTQLQIEISA-N 299.440 3.037 70 20 CGID CCOc1ccc(CNC(=O)Nc2ccc(C)nc2)cc1 217301076 YSLLLEPFFBQPJD-UHFFFAOYSA-N 285.347 3.110 70 20 CGID CC(C)C(=O)NCCCN[C@@H](C)c1ccccc1Cl 159978775 QDHRDGUOJCDVBF-LBPRGKRZSA-N 282.815 3.153 70 20 CGID CC1(C)CC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 776364022 PMEWDPSRKUSMEL-JTQLQIEISA-N 299.367 3.110 70 20 CGID C[C@H](c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](CN)C1 217513501 IBGDPNFHYIAESK-NEPJUHHUSA-N 286.341 3.437 70 20 CGID CC(C)C[C@H](CO)NC(=O)CCC(C)(C)c1ccccc1 161226210 ZDNDTXPOGLMGRF-MRXNPFEDSA-N 291.435 3.268 70 20 CGID Cc1nc(CN2c3ccccc3S[C@H](C)[C@@H]2C)no1 161253422 FQHXNTBCBXYWQF-VHSXEESVSA-N 275.377 3.267 70 20 CGID CCC1(CC)[C@@H](OC)C[C@H]1N[C@@H](C)c1ccncc1 160102077 CKXOETHGQDDVAP-CFVMTHIKSA-N 262.397 3.326 70 20 CGID Cc1ccc(N(C)C(=O)Cc2nc(C)sc2C)cc1 160128233 BWICBHPFRFIPKU-UHFFFAOYSA-N 274.389 3.274 70 20 CGID CCO[C@H](CC)C(=O)N[C@H]1CCCc2sccc21 160145621 IFCHGPRHPFAXBN-NWDGAFQWSA-N 267.394 3.057 70 20 CGID O=C(CCC1CCCC1)CSc1nncn1C1CC1 160201002 BPWFHABHVHGMJM-UHFFFAOYSA-N 279.409 3.245 70 20 CGID CCc1ncsc1C(=O)Nc1cc(C2CCCC2)[nH]n1 160410274 HFUFUMNRQJCZGJ-UHFFFAOYSA-N 290.392 3.339 70 20 CGID CCCC1(CNC(=O)CCCc2ccccn2)CC1 160475483 VXUOLMQGBHBEPR-UHFFFAOYSA-N 260.381 3.101 70 20 CGID CCc1nc(CN[C@H](CC2CCC2)c2ccccc2)n[nH]1 160672409 MKTUWHJMBQVPSW-OAHLLOKOSA-N 284.407 3.388 70 20 CGID CC[C@@H](NC(=O)Nc1ccccc1SC)[C@@H]1CCCO1 159432794 VSAFPFPBOLFSDL-YPMHNXCESA-N 294.420 3.488 70 20 CGID Cc1ccc(NC(=O)N(C)[C@@H]2CCSC2)c(F)c1 159438186 MQHJSLVFSMZMPE-SNVBAGLBSA-N 268.357 3.103 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H]2CCCc3c2cnn3C)C1 159451899 NXOHMMIVWODTET-KCQAQPDRSA-N 293.480 3.451 70 20 CGID CC(C)OC1CCC(NC(=O)CCCn2cccc2)CC1 159454220 FWUIBQTZYUHELP-UHFFFAOYSA-N 292.423 3.121 70 20 CGID CCCN1CCC(CNC(=O)C2CCC(C)(C)CC2)CC1 159650055 NUEIDOSICYPXFT-UHFFFAOYSA-N 294.483 3.441 70 20 CGID Cc1cc(F)ccc1NC(=O)N(C)[C@H]1CCSC1 159539762 CFYNWOMYNJGMKY-NSHDSACASA-N 268.357 3.103 70 20 CGID O=C(Cc1cccc2cccnc12)NCC1(C2CC2)CC1 159762604 DIHGUQIUXCDQKZ-UHFFFAOYSA-N 280.371 3.084 70 20 CGID Cc1cc(N[C@@H]2CCCc3cc(N)ccc32)ccn1 159495469 NSWRWPLNTSSHIV-MRXNPFEDSA-N 253.349 3.462 70 20 CGID c1ccc(CN(CCOCC2CC2)C[C@@H]2CCCO2)cc1 159548665 TVSOHIQESYALCP-SFHVURJKSA-N 289.419 3.094 70 20 CGID CC[C@@H](C)c1ccc(OCC(=O)N(CC)CC)cc1 217342252 ALMUANMQICTGNJ-CYBMUJFWSA-N 263.381 3.447 70 20 CGID CC[C@@H](C(=O)N[C@@H](C)C1CCOCC1)c1ccc(F)cc1 161137786 HVBQNLYNZMSGBX-BLLLJJGKSA-N 293.382 3.251 70 20 CGID CCCCOc1ccc(CCN[C@H](C)[C@@H]2CCOC2)cc1 161388090 QBFHLDJGZGCMIJ-NVXWUHKLSA-N 291.435 3.423 70 20 CGID Cc1noc(C)c1[C@@H](C)NC(=O)C[C@@H](C)c1ccncc1 160595363 VGJCGJJQOWKIBK-GHMZBOCLSA-N 287.363 3.057 70 20 CGID CCN(CC)CC(=O)N1CCC[C@H]1c1cc(C)ccc1C 160687054 YGGPRYOYHGIRGG-KRWDZBQOSA-N 288.435 3.309 70 20 CGID COc1cccc(CCCN2CCC[C@H](c3ccn[nH]3)C2)c1 159429304 UEGOPLZXMGZRKD-INIZCTEOSA-N 299.418 3.231 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)[C@H](C)c2ccncc2)o1 159497600 RDAUWOUDSJMINO-SBDDDAINSA-N 284.359 3.470 70 20 CGID CC(C)OCCCN1CCC(N(C)c2ccccc2)CC1 159741340 RQXITVFBFGLSNQ-UHFFFAOYSA-N 290.451 3.402 70 20 CGID CC1(C)C[C@H]1C(=O)Nc1ccc(OC(F)F)c(F)c1 159381266 VJIPNWVPVIWLBM-QMMMGPOBSA-N 273.254 3.412 70 20 CGID Fc1cc(Cl)cc(CNCc2cccc3c2OCO3)c1 160910529 ZGVYZZNGZDXSSZ-UHFFFAOYSA-N 293.725 3.498 70 20 CGID CS[C@@H]1CC[C@H](Nc2ncnc3c2CCCC3)C1 217809016 HNMWBSWXHWCINW-WDEREUQCSA-N 263.410 3.051 70 20 CGID C[C@@H]1CCC[C@H](CNCc2cn3ccccc3n2)C1 218237511 VOCDKRXHKMFZDT-KGLIPLIRSA-N 257.381 3.250 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCCc2ccc(O)cc21 217768629 SZMICHLXOWWWPG-CXAGYDPISA-N 276.424 3.090 70 20 CGID Cc1ccc(C(N)=O)cc1NCc1ccc([C@@H]2C[C@@H]2C)o1 160025281 SKVNMWUWOGQDLS-SMDDNHRTSA-N 284.359 3.422 70 20 CGID Cc1ncccc1C(=O)N[C@H]1CCCc2sccc21 160033991 PKXQPNXGUDZNMY-ZDUSSCGKSA-N 272.373 3.259 70 20 CGID CCO[C@@H](C)c1noc(COc2ccc3[nH]ccc3c2)n1 160072640 SYRNUKPISUAVEB-JTQLQIEISA-N 287.319 3.227 70 20 CGID CC(C)[C@H]1CCCCN1Cc1cnc2ccccn12 160485681 PXAPVUJVWDZCTQ-OAHLLOKOSA-N 257.381 3.345 70 20 CGID CC(C)[C@@H](CCO)NC(=O)C[C@@H](C)C1CCCCC1 160760028 LUAWXOXZKIYPIU-UKRRQHHQSA-N 269.429 3.116 70 20 CGID CCSCC[C@@H](C)NC(=O)C[C@@H](C)c1ccncc1 160926810 KZSNYZHLXSZZCS-CHWSQXEVSA-N 280.437 3.223 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)cc1C 160936284 ZLXCXHJSLOXBJG-HZPDHXFCSA-N 288.391 3.383 70 20 CGID CCCN(Cc1ccccc1)C(=O)[C@@H]1CCC(=O)C[C@@H]1C 159618616 OKKSIFOISPTULL-WMLDXEAASA-N 287.403 3.431 70 20 CGID CC(C)COCCCNC(=O)[C@H](C)OC1CCCCCC1 159710686 DDFMHXLBHWCYQO-HNNXBMFYSA-N 299.455 3.293 70 20 CGID O=C(CC(F)(F)F)N[C@@H]1CCCc2sccc21 159930853 QUMXPCAAEVSDMR-MRVPVSSYSA-N 263.284 3.194 70 20 CGID Cc1cccc([C@H](NC(=O)C2CC2)c2ccccn2)c1 159935353 LBARQUSDRYGWRB-INIZCTEOSA-N 266.344 3.006 70 20 CGID Cc1ccccc1[C@H](C)N[C@H]1CCN(c2ncccc2F)C1 159788486 TVZZMDCWINJTOY-GJZGRUSLSA-N 299.393 3.459 70 20 CGID CCOC(=O)CC1CCN(C(=O)[C@H]2CCC[C@H](C)C2)CC1 159984700 SXRKIEQLVKMQME-ZFWWWQNUSA-N 295.423 3.005 70 20 CGID CCCN(CC(=O)N(C)[C@H]1CCCC[C@@H]1C)CC1CC1 217200418 JEMCQWUWHDNCMA-HOCLYGCPSA-N 280.456 3.146 70 20 CGID O=C(NCCCCc1ccccc1)Nc1cccnc1 217264775 HBWXXSMZSKARNT-UHFFFAOYSA-N 269.348 3.226 70 20 CGID Cc1cccc(C(=O)N[C@@H](C)Cc2ccco2)c1F 161449942 XUIJCIPXYCROGO-NSHDSACASA-N 261.296 3.088 70 20 CGID Cc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)c(C)c1 217639833 BIRAQLCPVXAGPZ-SJORKVTESA-N 258.409 3.020 70 20 CGID CCc1ccc([C@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)o1 161141509 VOKWHUBYCHUZIT-MJBXVCDLSA-N 264.413 3.365 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1oc(C)nc1C 161322965 VZBNSVKTWBOXEE-QWHCGFSZSA-N 264.369 3.332 70 20 CGID Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C2)cn1 161366741 KCEHSOACTMRTLF-OAHLLOKOSA-N 281.359 3.411 70 20 CGID O=C(Cc1ccc(F)cc1Cl)N(CC(F)F)C1CC1 160100213 NPBFHDOSVGWDQE-UHFFFAOYSA-N 291.700 3.278 70 20 CGID CN(CCC1CC1)C(=O)Nc1ccc(-c2ccccc2)nn1 160117149 HWUUSZRNTILMMZ-UHFFFAOYSA-N 296.374 3.407 70 20 CGID C[C@H](NC(=O)N1CCc2cccc(F)c2C1)C1CCC1 160277358 SGWCYYOJJHIFDI-NSHDSACASA-N 276.355 3.082 70 20 CGID COCC(C)(C)C(=O)Oc1ccc2ccc(OC)cc2c1 160474656 OIESUOMMKQLMEV-UHFFFAOYSA-N 288.343 3.426 70 20 CGID CC(C)CSCCCNC(=O)c1cccc2cn[nH]c12 160665572 VCPMLIBHTRUKDM-UHFFFAOYSA-N 291.420 3.072 70 20 CGID C[C@H](CCC(=O)NC[C@H]1CCCC[C@@H]1O)c1ccccc1 160725635 RNYLFNKBVNNXKU-OIISXLGYSA-N 289.419 3.238 70 20 CGID Cc1ccccc1C(=O)N[C@H](C)CC(=O)c1cccs1 160861292 DJFQCRGYTXZSHX-GFCCVEGCSA-N 287.384 3.448 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H]2C[C@H](C)N(C)C[C@@H]2C)C1 159403145 NNUCWVZOGIVNEK-RFBLXINOSA-N 284.513 3.369 70 20 CGID CCCCCNC(=O)[C@H](C)N[C@H](C)c1cccc(F)c1F 159533395 NSQWOKIPXBAADP-NEPJUHHUSA-N 298.377 3.310 70 20 CGID Fc1ccc(CN(CCOCC2CC2)C2CC2)c(F)c1 159368183 REGUYSPNQAKDDF-UHFFFAOYSA-N 281.346 3.356 70 20 CGID O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1ccc(F)c(F)c1 159956115 YCKKNGGGRYQKKH-CPUCHLNUSA-N 299.320 3.281 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2NC(=O)CCC(F)(F)F 159368545 YJINIFIQFRUTSF-GFCCVEGCSA-N 286.297 3.105 70 20 CGID Cc1ccc2[nH]c(-c3c[nH]c4ccccc34)nc(=O)c2c1 217348736 RABGTJREUCKSCQ-UHFFFAOYSA-N 275.311 3.380 70 20 CGID Cc1ccc(C(=O)NC2(C)CCC2)c(Br)c1 159943965 AXAWKHCOBQZVHM-UHFFFAOYSA-N 282.181 3.430 70 20 CGID CN1[C@H]2CC[C@H]1CC(N[C@H](c1ccccc1)C1CC1)C2 217984806 MWJQCKIWMWTBQQ-OKZBNKHCSA-N 270.420 3.353 70 20 CGID c1ccc(C[C@@H]2CCN(CCCN3CCCCC3)C2)cc1 161232474 GRXPFSWFQUVXSM-IBGZPJMESA-N 286.463 3.427 70 20 CGID Cc1ccc(C(=O)Nc2ccc3nc(N(C)C)oc3c2)o1 161233067 CRTMYOBLKVKTTF-UHFFFAOYSA-N 285.303 3.048 70 20 CGID CC(C)C1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)CC1 160279588 OFGBOKNQGRZOON-CVEARBPZSA-N 294.439 3.022 70 20 CGID Cc1c(CNCc2ccc(-c3ccccc3)o2)cnn1C 160390974 PTCHYIJGTDWBTO-UHFFFAOYSA-N 281.359 3.278 70 20 CGID O=C(/C=C/SCc1ccco1)Nc1cccc(F)n1 160572613 CCFMUEWNCHZMJH-SOFGYWHQSA-N 278.308 3.199 70 20 CGID Cc1ccc(C)c(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1 160632213 BQUCFXWRALBUHM-CYBMUJFWSA-N 276.380 3.383 70 20 CGID Cc1cc(F)c(C(=O)NC(C2CC2)C2CC2)cc1F 160658220 MSHNHRGWOMKWFW-UHFFFAOYSA-N 265.303 3.192 70 20 CGID O=C(NCCOc1ccccc1Cl)[C@@H]1CC=CCC1 159400808 PGXIZRIDKTXUSH-GFCCVEGCSA-N 279.767 3.191 70 20 CGID COc1ccc(C(C)(C)C(=O)N2CCCC[C@H]2C)cc1 159468488 SBESPSLQZQJIKG-CYBMUJFWSA-N 275.392 3.374 70 20 CGID CC(=O)NC1CCN(CC2CCC(C(C)(C)C)CC2)CC1 159871635 WIZISGRWUKQKGB-UHFFFAOYSA-N 294.483 3.439 70 20 CGID Cc1cc(C(=O)NCCOc2ccccc2Cl)c(C)o1 159375476 QCSCOXLYZUPGKR-UHFFFAOYSA-N 293.750 3.359 70 20 CGID CCCCn1ncc(NC(=O)N[C@H]2C=CCCC2)c1C 159766668 OZVCCAGXSOAWQB-ZDUSSCGKSA-N 276.384 3.222 70 20 CGID COC(=O)c1ccc(NC(=O)N[C@@H](C)CC(C)C)cc1 159977777 ITIRDWMLAGBHNR-NSHDSACASA-N 278.352 3.029 70 20 CGID CCC[C@H]1CN(C(=O)NCc2ccc(CC)s2)CCO1 159790799 BTLPVVLMJDKIAX-LBPRGKRZSA-N 296.436 3.021 70 20 CGID CCCn1nccc1CNCC(C)(C)c1ccccc1 160106008 PPXUZIXBZUEMAC-UHFFFAOYSA-N 271.408 3.361 70 20 CGID CCN(CCCO)C(=O)CCSc1ccc(C)c(C)c1 160559467 MGXOSFXEKAVFJR-UHFFFAOYSA-N 295.448 3.017 70 20 CGID CCCCCC[C@H](C)OCCCS(=O)(=O)Cl 112155296 PDFJLDFNAAMTNZ-NSHDSACASA-N 270.822 3.321 70 20 CGID CCOc1ccc(CNC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 217300897 RJVYGKNJHYHWQK-XJKSGUPXSA-N 290.407 3.463 70 20 CGID CCSCC[C@H](C)Nc1ncnc(CC)c1F 218051985 OPBIJAOCNCBINL-VIFPVBQESA-N 257.378 3.122 70 20 CGID c1ccc2[nH]c(CSCc3ccncc3)nc2c1 218711295 MEUDAGCPLGLYSY-UHFFFAOYSA-N 255.346 3.391 70 20 CGID CC1(C)CCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 776368052 NEUXPTIPIFRYMK-LBPRGKRZSA-N 299.367 3.110 70 20 CGID CC(C)[C@H]1CC[C@@H](C)C[C@@H]1N[C@@H]1CCN(C2CC2)C1 217784788 ZCQVNXGCWWAJHD-SRABZTEZSA-N 264.457 3.274 70 20 CGID Cc1ccccc1[C@H](C)NC(=O)N[C@@H]1C=CCCC1 161345687 NBFDNDTZIRMHDV-UONOGXRCSA-N 258.365 3.464 70 20 CGID CS[C@@H](C)CNC(=O)Nc1ccc(OC(C)C)cc1 160591028 ZCYCTNRQVKTCSU-NSHDSACASA-N 282.409 3.347 70 20 CGID Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCC[C@@H](C)C2)cn1 160730624 RUIDTSYEFDBSBB-TZMCWYRMSA-N 298.390 3.341 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)N[C@H]3C[C@@H]3C)c2C)c1 160743975 QCRHTKGZYQWZBN-JSGCOSHPSA-N 298.390 3.327 70 20 CGID N[C@@H]1CCC[C@H](NC(=O)CCc2ccc3ccccc3c2)C1 160856286 FRGOCIIGAZHECP-MSOLQXFVSA-N 296.414 3.159 70 20 CGID CS[C@@H](C)CC(=O)NC[C@@H](C)COCc1ccccc1 160903461 OIGOJJQPWSCSNQ-KGLIPLIRSA-N 295.448 3.097 70 20 CGID C[C@H](CCn1cccn1)Nc1cccc(OCCF)c1 159474829 XHJBIRNIKDWROX-CYBMUJFWSA-N 277.343 3.122 70 20 CGID O=C(NC[C@H](c1cccs1)N1CCCC1)C1=CCCC1 159670464 OXAAZOPYAPEFRI-CQSZACIVSA-N 290.432 3.112 70 20 CGID CCCOCC(=O)N1C[C@@H](C)CSc2ccccc21 159675591 MLBQYVLFSAYVTC-GFCCVEGCSA-N 279.405 3.188 70 20 CGID CCOc1ccccc1OC(=O)Cc1nc(C)sc1C 159483511 AQKZIXIKGKOYQP-UHFFFAOYSA-N 291.372 3.307 70 20 CGID CCCCCCNC(=O)CSCc1c(CC)noc1C 159989061 AFHFXZCAIPUEEX-UHFFFAOYSA-N 298.452 3.475 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2cc(Cl)ccc2N)O1 160779873 KCUHHOFCTPTHRH-JTQLQIEISA-N 283.755 3.037 70 20 CGID O=C(NCCc1ccccc1)NCCC1CCCCC1 217305071 VMLHTOGCTJTDPC-UHFFFAOYSA-N 274.408 3.499 70 20 CGID COc1cc(Cl)ccc1CNC(=O)NC1(C)CCC1 160982584 SFDQMAMYZFDGKJ-UHFFFAOYSA-N 282.771 3.090 70 20 CGID Nc1cc(F)cc(C(=O)OCCc2cccs2)c1F 217924392 UZZPOSWKHHNKPA-UHFFFAOYSA-N 283.299 3.008 70 20 CGID COCc1nc(C)cc(N[C@H]2CCCc3sccc32)n1 161067504 OJIUEPCBAULFFI-LBPRGKRZSA-N 289.404 3.482 70 20 CGID CCCn1nccc1CNc1ccc(N(CC)CC)nc1 160035512 DVOJHUHDZJNVBE-UHFFFAOYSA-N 287.411 3.146 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)NCCC(C)C 160086797 ZZOQLGIKOXCRAX-GFCCVEGCSA-N 298.452 3.329 70 20 CGID Cc1ccccc1-c1cccc(CN2CCC[C@H]2C(N)=O)c1 160341141 IMMZDYXMSYKPQD-SFHVURJKSA-N 294.398 3.112 70 20 CGID C/C(=C\C(=O)N[C@H]1CCOC2(CCCCC2)C1)C1CC1 160704912 RZCNKLKMTNAVLQ-FQNOHDAGSA-N 277.408 3.341 70 20 CGID CCN(C(=O)N[C@@H]1CCN(C2CCCC2)C1)[C@@H](C)C(C)C 160901496 DBUKXXIQKBQLMS-LSDHHAIUSA-N 295.471 3.079 70 20 CGID Cc1cccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1C 160932150 RPRVHUVMQBXITO-GDBMZVCRSA-N 288.391 3.383 70 20 CGID CCCN1CCC(NC[C@@H]2CCc3ccccc32)CC1 160955509 AMAULUVJJICCGM-INIZCTEOSA-N 272.436 3.180 70 20 CGID CO[C@@H]1CCC[C@H]1NC(=O)N[C@@H](c1ccccc1)C1CC1 159606211 KWIYLGOMXWHJCP-OAGGEKHMSA-N 288.391 3.004 70 20 CGID COc1ccc(CN(C)Cc2c[nH]nc2C(C)(C)C)cc1 159864983 WXFQNDNFLZJHOM-UHFFFAOYSA-N 287.407 3.348 70 20 CGID Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C 159695041 VDQSLSZIXTUOHB-HOTGVXAUSA-N 276.424 3.182 70 20 CGID CNC[C@H](C)C(=O)N1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 159781585 HBDRCDHCJJYYAE-VYDXJSESSA-N 288.435 3.150 70 20 CGID CCCN1CCC(Nc2ccc(F)c(OC)c2)CC1 159923723 AVEGYUMBRFGWSF-UHFFFAOYSA-N 266.360 3.121 70 20 CGID CCC(CC)CNC(=O)N1CC[C@@H]2CCCC[C@@H]21 160537010 LIWOFRCYTISQBY-KBPBESRZSA-N 252.402 3.397 70 20 CGID CCN(C(=O)Cc1cc(F)c(F)cc1F)c1ccncc1 161069932 MKJLDVZBFGIQFO-UHFFFAOYSA-N 294.276 3.095 70 20 CGID CCCCN(CC)C(=O)c1cc(OC)c(OC)cc1F 161285890 NBCKBRPLBTYPSK-UHFFFAOYSA-N 283.343 3.105 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc(F)c(F)cc1F 160016209 NURQZOJBNKLWEC-UHFFFAOYSA-N 269.266 3.024 70 20 CGID Cc1n[nH]cc1CN(C)Cc1ccccc1Br 160386580 ZXOBPZUWMHGYFQ-UHFFFAOYSA-N 294.196 3.113 70 20 CGID COC[C@H](NCCCCc1nc(C)cs1)C(C)C 160694837 CPEWONKPEREBBM-ZDUSSCGKSA-N 270.442 3.035 70 20 CGID Cc1cc(C)cc(NC(=O)N[C@H]2CCOC(C)(C)C2)c1 160830560 VIWQVVPKGVQZSA-ZDUSSCGKSA-N 276.380 3.383 70 20 CGID Cc1ccccc1[C@@H]1C[C@@H](C)N(CCn2ccnc2)C1 159838944 HHKRLIPLENNQRG-HZPDHXFCSA-N 269.392 3.070 70 20 CGID O=C(Oc1cc(Cl)ccc1Cl)[C@H]1CCCCO1 159682520 MOZHUIWQBBYKNG-SNVBAGLBSA-N 275.131 3.468 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2OC)cc1 160094310 KVLCDICXPXCMCD-APHBMKBZSA-N 263.381 3.303 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2ccc(N)c(Cl)c2)O1 160793096 ASYMLDUFFOZISJ-JTQLQIEISA-N 283.755 3.037 70 20 CGID O=[N+]([O-])c1ccc(Oc2cccc([B-](F)(F)F)c2)cc1 514260716 DYRBPVFTEWMLNQ-UHFFFAOYSA-N 282.006 3.442 70 20 CGID CC[C@H](C)CCC(=O)Nc1cccc(S(=O)(=O)F)c1 808739940 GZPJTXGDPOHLRA-JTQLQIEISA-N 287.356 3.110 70 20 CGID C[C@@H](c1ccc2ccccc2c1)N1CCC[C@@H](N)C1 217500115 BABCLJOAWKHQDX-SUMWQHHRSA-N 254.377 3.324 70 20 CGID C[C@H](SCc1nncn1C)c1ccc(Cl)cc1 161041581 TVDHFGUZHUZXOU-VIFPVBQESA-N 267.785 3.463 70 20 CGID Cc1nc(C(C)C)sc1[C@@H](C)NC1CCN(C)CC1 161441494 WFIMRLDEBCNMQR-LLVKDONJSA-N 281.469 3.320 70 20 CGID CC[C@@H](C)N(C)CCNC(=O)c1ccc2nc(C)ccc2c1 161469285 SASPPOVQAUDPIC-CQSZACIVSA-N 299.418 3.003 70 20 CGID CCS[C@@H](C(=O)NCC1(C2CC2)CC1)C(C)C 160036602 MCNUQOJCLDWJHD-GFCCVEGCSA-N 255.427 3.071 70 20 CGID CC(C)n1cc(Nc2nnc(C(F)(F)F)s2)cn1 160331723 CBRDXCPZAFRXJC-UHFFFAOYSA-N 277.275 3.078 70 20 CGID CCSCCNC(C)(C)c1ccccc1OC 160550603 CBIBRTLXSGFYOI-UHFFFAOYSA-N 253.411 3.273 70 20 CGID COc1ccc(CCCN(C)C(=O)C[C@@H](C)SC)cc1 160766800 HJPFLUBFUCQWNK-CYBMUJFWSA-N 295.448 3.228 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccncc1 159923244 KMZHDLIFUYNLGV-RYUDHWBXSA-N 258.346 3.194 70 20 CGID CCOC(=O)[C@H](N[C@@H]1CCC(C)(C)C1)c1ccccc1 218749748 BVAUUQGYHPHTNH-HUUCEWRRSA-N 275.392 3.459 70 20 CGID CCc1ccc(/C=C/C(=O)N2C[C@@H]3CCC[C@H]3C2)o1 161003621 XGTOYLLOPXLQOI-TYDXBBDOSA-N 259.349 3.114 70 20 CGID CC(C)C1CCC(NC(=O)c2ccnn2C(C)C)CC1 161244413 APRAISPZMQPFHT-UHFFFAOYSA-N 277.412 3.409 70 20 CGID CC(C)(C(=O)N1CCC[C@@H](c2ccn[nH]2)C1)C1CCCC1 161251603 OPRSPMVRBPZKES-CYBMUJFWSA-N 289.423 3.332 70 20 CGID CC[C@H](C)OCC(=O)NCc1oc2ccc(F)cc2c1C 161282574 HQJGWUMTMXSGQT-JTQLQIEISA-N 293.338 3.312 70 20 CGID FC(F)(F)COCCCn1nc(C2CC2)nc1C1CC1 161452270 GIPUNQBVWBPGIU-UHFFFAOYSA-N 289.301 3.002 70 20 CGID CO[C@H](C)CCC(=O)N[C@@H]1CCCc2sccc21 160163135 NSGFRDWFYPTBKA-ZYHUDNBSSA-N 267.394 3.057 70 20 CGID CSCC[C@H](C)N(C)Cc1c(C)nc2ccccn12 160508364 JGUCFRIPSKBDEY-LBPRGKRZSA-N 277.437 3.216 70 20 CGID CC(C)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 160614360 LPFMMYMWKAWUBE-UHFFFAOYSA-N 290.750 3.494 70 20 CGID CCC(C)(C)NC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 160914198 ROZJKXQXPMACJY-LSDHHAIUSA-N 290.407 3.395 70 20 CGID Cc1ccc(NC(=O)NC2CC=CC2)cc1OCC(F)F 159605389 OKIIRTXAGYEIAM-UHFFFAOYSA-N 296.317 3.479 70 20 CGID COc1ccc(N(C)C(=O)[C@@H](C)OCCC(C)C)cc1F 159838389 IFNVWUORKAZSOQ-GFCCVEGCSA-N 297.370 3.248 70 20 CGID COc1ccc(N(C)C(=O)c2sccc2OC)cc1F 159372036 XAUJQDUVVHCCHC-UHFFFAOYSA-N 295.335 3.181 70 20 CGID C[C@@H]1C[C@H]1c1ccc(CN[C@@H]2CCOC(C)(C)C2)o1 160554093 ACQVNNZKJCFYLR-YRGRVCCFSA-N 263.381 3.450 70 20 CGID CSc1nc2ccc(NC(=O)C(F)F)cc2s1 217654233 RNHSMIBBMNMSLL-UHFFFAOYSA-N 274.317 3.222 70 20 CGID CCc1ncnc(N[C@H](C)Cc2ccsc2)c1F 217985583 IBHYXRRUBWKFGM-SECBINFHSA-N 265.357 3.283 70 20 CGID COc1cccc(NC(=O)Nc2cc(Cl)ccn2)c1 217273326 KPVIBQMSAQSGMI-UHFFFAOYSA-N 277.711 3.388 70 20 CGID CC(C)(C)C1=CCN(C(=O)OCC(F)(F)F)CC1 160794897 DRYULMSGSDKBIR-UHFFFAOYSA-N 265.275 3.364 70 20 CGID O=S(=O)(Cl)[C@@H](CC(F)(F)F)c1ccccc1 88251111 YVPWFYFQSOZQAA-QMMMGPOBSA-N 272.675 3.249 70 20 CGID CC(C)[C@@H](NC(=O)NO[C@@H]1CCCCO1)c1ccccc1 161491120 ZWICXYQHOAVTHE-HUUCEWRRSA-N 292.379 3.141 70 20 CGID CCC1(CC)[C@H](N[C@@H](C)c2cccnc2)C[C@H]1OC 160109968 PYSKPZJXSUEWBK-NWANDNLSSA-N 262.397 3.326 70 20 CGID Cc1nc(O)ccc1C(=O)N1CCC[C@H]1C1CCCCC1 160126847 LXXOBTHLQWGICA-HNNXBMFYSA-N 288.391 3.281 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)Nn1cnc2ccccc21 160385570 JJXFSSXETQJUPU-NWDGAFQWSA-N 297.383 3.280 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCC1(c2ccccc2)CC1 160414947 SQRXNLNSDQYJON-HOCLYGCPSA-N 257.377 3.271 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@@H]1CSCCc2ccccc21 160604151 TWFUEGLLNQATSB-OIISXLGYSA-N 291.460 3.158 70 20 CGID CCCNC(=O)NCC1(c2ccccc2Cl)CC1 160642427 RBUOJFIRIKDCAI-UHFFFAOYSA-N 266.772 3.081 70 20 CGID CCOCCC1(C(=O)N(C)Cc2ccsc2)CCC1 160678755 FRNHPMLPAKDTPD-UHFFFAOYSA-N 281.421 3.303 70 20 CGID COC(=O)c1csc(NC(=O)N(C)[C@@H](C)C2(C)CC2)c1 160714035 KVKAXLSXZDGHEL-VIFPVBQESA-N 296.392 3.187 70 20 CGID Cc1c(NC(=O)C2(CN)CCCC2)sc2c1CCCC2 160986484 UVTYPPHILBCMOD-UHFFFAOYSA-N 292.448 3.393 70 20 CGID O=C(Nc1cc(F)ccc1F)N[C@@H]1CCO[C@H](C2CC2)C1 160990116 LLUQFRKRPVOGOI-RISCZKNCSA-N 296.317 3.044 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H]2C2CC2)n1 160998200 PTNIZIJGQWWNGA-STQMWFEESA-N 296.374 3.019 70 20 CGID CN(C(=O)COc1ccc(Cc2ccccc2)cc1)C1CC1 159428153 MPDKCNNKJRMDFB-UHFFFAOYSA-N 295.382 3.277 70 20 CGID CCC[C@H](C)NC(=O)[C@@H](C)Nc1ccn(CCC(C)C)n1 159921432 RZBOILXSKLPYCQ-UONOGXRCSA-N 294.443 3.034 70 20 CGID CCCn1nccc1CN[C@H]1CCCc2ccccc21 159982475 WJONVPPRQHZCNU-KRWDZBQOSA-N 269.392 3.460 70 20 CGID CCCOc1cccc(CNCC2(CO)CCCC2)c1 160109228 CXUGFUFUKMESPS-UHFFFAOYSA-N 277.408 3.118 70 20 CGID c1nc2ccc(-c3ccc(N4CCCC4)nc3)cc2[nH]1 218724276 GSZLAOGWBBEQFV-UHFFFAOYSA-N 264.332 3.225 70 20 CGID FC(F)CN(Cc1noc(C2CCCCC2)n1)C1CC1 160059377 IVKLKRIQYVKPAI-UHFFFAOYSA-N 285.338 3.347 70 20 CGID CN(C)[C@H]1CCC[C@H](N[C@@H]2CCc3ccccc32)C1 161034647 BOXOVJHDLKZTBA-YQQAZPJKSA-N 258.409 3.136 70 20 CGID CN(CCCNc1cccc(F)n1)C1CCCCC1 218119569 BXDZEQCXEFMZHH-UHFFFAOYSA-N 265.376 3.287 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1c1nc([C@@H]2CCOC2)no1 161028352 RWWLBITYVCSFEG-MXWKQRLJSA-N 276.361 3.215 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1ccccc1C 161065786 XGHPPKCEYZDAJX-SFHVURJKSA-N 263.362 3.162 70 20 CGID C[C@@H](NC(=O)N[C@H]1CCOC(C)(C)C1)c1ccccc1 161100769 NBALLTBLJOSYPC-OCCSQVGLSA-N 276.380 3.004 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccncc1 159923380 KMZHDLIFUYNLGV-VXGBXAGGSA-N 258.346 3.194 70 20 CGID Cc1cc(Cl)cc(C(=O)Nc2ccncc2O)c1 159734241 UIBOBPGACCURBK-UHFFFAOYSA-N 262.696 3.001 70 20 CGID CCCCOCCCN[C@H](C)C[C@@H]1CCCCCN1 160259254 LTWAHOUDPWRRMX-CVEARBPZSA-N 270.461 3.094 70 20 CGID CC[C@H]1CCCC[C@H]1NCc1noc(C(C)(C)C)n1 161433953 LHUBTFIMHASTON-NWDGAFQWSA-N 265.401 3.426 70 20 CGID C[C@@H]1CN(C(=O)c2ccc(CN)o2)CC[C@@H]1c1ccccc1 161234725 BRVHSNXLLHAUJA-CJNGLKHVSA-N 298.386 3.004 70 20 CGID CC(C)(C)NC(=O)c1cccc(NCc2ccco2)c1 160197086 UXNIZKOAALACNL-UHFFFAOYSA-N 272.348 3.420 70 20 CGID COc1ccc([C@@H](NC(=O)[C@@H]2CCCCO2)C(C)C)cc1 160230541 JBQJEZVMYAJXKU-HOTGVXAUSA-N 291.391 3.078 70 20 CGID CCC(N)(CC)CNC(=O)C[C@@H](c1ccccc1)C(C)C 160419722 JDPFXPKDHOQLDI-MRXNPFEDSA-N 290.451 3.450 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1cccc(F)n1 160542134 CLHNUIDSAIWRLD-VHSXEESVSA-N 276.336 3.333 70 20 CGID CC(=O)c1csc(C(=O)NCCCSCC(C)C)c1 160850951 TXIPYSSKVJQKHA-UHFFFAOYSA-N 299.461 3.460 70 20 CGID COc1cccc(CCCn2cnc(C(C)C)cc2=O)c1 160886575 DWEOQBGZPANEHP-UHFFFAOYSA-N 286.375 3.008 70 20 CGID COc1ccccc1CC(C)(C)C(=O)NC1CC=CC1 160886787 VQRPOCSGKCVKQI-UHFFFAOYSA-N 273.376 3.099 70 20 CGID COc1cc(NC(=O)N2CCCCCC2)ccc1F 160228983 IYNQUAHODIHAGK-UHFFFAOYSA-N 266.316 3.242 70 20 CGID CCSCC[C@H](C)NC(=O)C[C@@H]1CNc2ccccc21 160227908 DQCPERHEMMFCKT-QWHCGFSZSA-N 292.448 3.234 70 20 CGID NC(=O)Cc1ccc(NCc2cc(F)cc(Cl)c2)cc1 160867125 SLMSVEQAAYTTKP-UHFFFAOYSA-N 292.741 3.119 70 20 CGID CC(C)C[C@@H](CO)NC(=O)c1cc2ccc(F)cc2s1 161191007 IORUKLUQTBUBEC-LBPRGKRZSA-N 295.379 3.177 70 20 CGID CC(C)C[C@H](CNCc1cccc2cc[nH]c12)N(C)C 218099840 MWBNMMNQPOSUBI-MRXNPFEDSA-N 273.424 3.234 70 20 CGID C[C@@H]1CCC[C@H](CNC(=O)c2[nH]nc3ccccc23)C1 218009233 VWRMEIBSRRUEPD-NEPJUHHUSA-N 271.364 3.119 70 20 CGID CCCCO[C@@H](C)C(=O)Nc1cccc(OCCF)c1 160406033 XIDOXOKCMICCIN-LBPRGKRZSA-N 283.343 3.179 70 20 CGID CCc1cccc(C)c1NC(=O)/C=C/c1cnn(C)c1C 160639263 LYVNRTVVNQXIQC-MDZDMXLPSA-N 283.375 3.251 70 20 CGID C[C@@H]1CCCN(C(=O)N[C@@H]2CCCC(C)(C)C2)C1 160720747 BQPORXMABPQGTR-CHWSQXEVSA-N 252.402 3.397 70 20 CGID CCCCN(C)C(=O)NCC1(Cc2ccccc2)CC1 160754615 ASNOOHIZGVGCPM-UHFFFAOYSA-N 274.408 3.451 70 20 CGID CN(CC1CCOCC1)C(=O)N[C@@H]1C[C@H]1C1CCCCC1 159419316 FIJMIETXDNDDEM-JKSUJKDBSA-N 294.439 3.023 70 20 CGID O=C(NCCc1cscn1)N1CCC[C@H]1C1CCCC1 159438585 AXHIRROXMFQTDG-AWEZNQCLSA-N 293.436 3.050 70 20 CGID COc1ccc(N(C)C(=O)c2oc(C)cc2C)cc1F 159861033 OPAFUJXGRKECFS-UHFFFAOYSA-N 277.295 3.321 70 20 CGID Cc1csc(NC(=O)c2ccc(C(C)C)nc2)n1 159472696 SPRUJIKQUAAARQ-UHFFFAOYSA-N 261.350 3.222 70 20 CGID COc1ccc(N(C)C(=O)[C@@H]2CC=CCC2)cc1F 159484833 ARFLUTWFQYJLDB-LLVKDONJSA-N 263.312 3.153 70 20 CGID CCC[C@@H]1CN(CCC(=O)c2ccc(C)cc2)CCO1 161137765 UANORPJCWVXJML-MRXNPFEDSA-N 275.392 3.069 70 20 CGID CCC[C@@H](NC1CCN(C)CC1)c1ccc(OC)cc1 161430232 IUQHICJMCXCQRS-QGZVFWFLSA-N 276.424 3.220 70 20 CGID CN(C)c1ccc(NC(=O)NCc2ccccc2F)cc1 217311479 FBLJTHOSNHDCAJ-UHFFFAOYSA-N 287.338 3.213 70 20 CGID CN(CC1=CCCOC1)Cc1ccc(OC(F)F)cc1 160629030 OQKCZLNNHUPQBL-UHFFFAOYSA-N 283.318 3.067 70 20 CGID Cc1cc(OCC(=O)N2[C@H](C)CC[C@H]2C)ccc1Cl 161408383 MDUCIUTYSAOPEF-VXGBXAGGSA-N 281.783 3.427 70 20 CGID CN(CC1CCOCC1)C(=O)NCC1CCC(C)(C)CC1 160321743 DEMGEPGEPRGHPO-UHFFFAOYSA-N 296.455 3.271 70 20 CGID O=C(CC1CCC1)N[C@H]1CCOC2(CCCCC2)C1 160408055 ROCXWQSAOKNZPP-AWEZNQCLSA-N 265.397 3.175 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@@H]2CCC[C@@H]2C)n1 160486711 XQHPXZYJBPUCOJ-QWHCGFSZSA-N 278.400 3.239 70 20 CGID CCN(CC)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1 160549918 IGDUVBCHWYEPFU-LBPRGKRZSA-N 296.798 3.255 70 20 CGID CCO[C@@H]1C[C@@H](N(C)C(=O)NCCC(C)C)C12CCC2 160645501 PQVDPHFHMNNEAB-ZIAGYGMSSA-N 282.428 3.022 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)C1CCCCC1 160860355 NQZDUYYQRDBWAK-LLVKDONJSA-N 279.405 3.406 70 20 CGID C[C@H](OCC1CC1)C(=O)N[C@H]1CCCc2sccc21 159839320 JUBNGAIVMKYORR-GWCFXTLKSA-N 279.405 3.057 70 20 CGID Cc1ccc(O)c(NC(=O)COC/C=C/c2ccccc2)c1 159655638 XAQBLPPONOVTGZ-VMPITWQZSA-N 297.354 3.369 70 20 CGID CN(CCc1c(F)cccc1Cl)C[C@@H]1CCC[C@@H]1O 159590524 NAMGFTUIAMHPBJ-NHYWBVRUSA-N 285.790 3.114 70 20 CGID O=S(=O)(Cl)N(Cc1ccccc1)Cc1ccccc1 106525294 YTJDHKOQYOTSCN-UHFFFAOYSA-N 295.791 3.172 70 20 CGID CC1(C)C[C@H](NCc2cccc3[nH]ccc23)CCO1 160524915 GZEMYMWINIGUCX-CYBMUJFWSA-N 258.365 3.215 70 20 CGID CCCC[C@H](CC)COCCCS(=O)(=O)Cl 112395389 GHSVZFNWMYJNKO-NSHDSACASA-N 270.822 3.178 70 20 CGID CC(C)C[C@H]1CCCCCN1C(=O)CCNC(C)C 161298233 DRDOUUOEMPCQBZ-OAHLLOKOSA-N 268.445 3.192 70 20 CGID CC[C@@H](SC)c1nc(-c2cccc(C(=O)OC)c2)no1 161373611 SBSXEEALPNKNOX-LLVKDONJSA-N 292.360 3.337 70 20 CGID CCOCCC1(CNC(=O)N(C)Cc2ccsc2)CC1 161495183 ZGDYHGQXZZKDLS-UHFFFAOYSA-N 296.436 3.096 70 20 CGID Cc1cccc([C@@H](C)N[C@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 160143185 BLCMZPHUZURCFN-OEAJRASXSA-N 259.393 3.459 70 20 CGID Cc1noc(C)c1[C@H](C)NC(=O)C[C@H](C)c1ccncc1 160595637 VGJCGJJQOWKIBK-QWRGUYRKSA-N 287.363 3.057 70 20 CGID CCCC[C@@H](CC)CC(=O)N[C@H](CO)CC(C)C 160642518 AQCCKRMQHZCLDQ-KGLIPLIRSA-N 257.418 3.116 70 20 CGID O=C(NCC1(Cc2ccccc2)CC1)N1C[C@H]2CCC[C@H]2C1 160750700 UNUSLEQHJLZZGZ-CALCHBBNSA-N 298.430 3.451 70 20 CGID Cc1ccc(NC(=O)N(C)[C@@H]2CCSC2)cc1F 159416835 UFGPMJXIFMMLBV-LLVKDONJSA-N 268.357 3.103 70 20 CGID O=C(CCCn1cccc1)N[C@@H]1C[C@H]1c1ccccc1F 159473031 KHXSNWBKTYTTPD-GOEBONIOSA-N 286.350 3.080 70 20 CGID CC(C)c1cccc(NC(=O)N[C@@]2(C)CCOC2)c1 159696407 BASUQRLROOHJSL-HNNXBMFYSA-N 262.353 3.111 70 20 CGID Cc1nc(CNC(=O)Nc2ccnc(C)c2Cl)cs1 159703679 BFLTVVQWRKUGFT-UHFFFAOYSA-N 296.783 3.130 70 20 CGID Cc1nc(NC(=O)C[C@H]2CC[C@@H](C)C2)cc(C2CC2)n1 159956188 NCWVGCKTKNWXAR-PWSUYJOCSA-N 273.380 3.427 70 20 CGID CC(C)(C)c1nsc(NC[C@](C)(O)c2cccs2)n1 159592573 VTOIIVINQAOWFU-ZDUSSCGKSA-N 297.449 3.217 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccccc1Cl 159752667 KOPIIXOXTGQBBX-UHFFFAOYSA-N 284.787 3.260 70 20 CGID CCOc1cc(CN[C@@H](C)CCSCC)ccc1O 160063287 XDLLCAHOYXDCMQ-LBPRGKRZSA-N 283.437 3.412 70 20 CGID COc1ccc(CNCc2cc(F)cc(Cl)c2)cn1 160823598 VQXFPOXFMAZOGL-UHFFFAOYSA-N 280.730 3.173 70 20 CGID Cc1ccc(CN(C)Cc2ccc(N(C)C)nc2)cc1 160641159 JXEZDCUGTPRVRV-UHFFFAOYSA-N 269.392 3.088 70 20 CGID CCCC[C@H](CNC(=O)OC(C)(C)C)NCC(C)C 218122051 LNGNWQPEUFUEFM-CYBMUJFWSA-N 272.433 3.316 70 20 CGID Fc1ccc(-c2ccn(Cc3nccs3)n2)cc1 161308687 VKRVYHOVEFBSLK-UHFFFAOYSA-N 259.309 3.194 70 20 CGID CCC[C@H]1SCCN1C(=O)c1scnc1CC 160253075 LUPHUTKERRNEQG-SNVBAGLBSA-N 270.423 3.021 70 20 CGID CC[C@@H](C)N(C)CCCc1nc(-c2ccccc2)no1 160342088 ZLCJJCCPAPGUET-CYBMUJFWSA-N 273.380 3.400 70 20 CGID CCC(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 160617317 LMTOAONNZNBTFH-UHFFFAOYSA-N 276.723 3.248 70 20 CGID c1csc(N2CCN(c3nccc4occc34)CC2)c1 160668929 AGZVWNQHDDDQKH-UHFFFAOYSA-N 285.372 3.216 70 20 CGID CCn1nc(C)c(NC(=O)C[C@@H](C)c2ccncc2)c1C 160739253 NCZDDUMSUWLECN-LLVKDONJSA-N 286.379 3.047 70 20 CGID Cc1ncc([C@@H](C)NC[C@H]2CCc3ccccc32)c(C)n1 160970884 LJTANHGQIMEIGJ-MLGOLLRUSA-N 281.403 3.474 70 20 CGID Cc1cccc(COc2ccc([C@H](C)NCCO)cc2)c1 159721600 MAUXSYIYALTDIO-HNNXBMFYSA-N 285.387 3.217 70 20 CGID COc1ccc2c(c1)C[C@@H](NC[C@@H](C)C1CC1)CC2 159555247 FRFMRLAXCUBWIP-WBMJQRKESA-N 259.393 3.188 70 20 CGID C[C@H](NCC1(c2ccc(F)cc2)CC1)C1CCOCC1 161382558 HLWBIRDDLQNQLJ-ZDUSSCGKSA-N 277.383 3.262 70 20 CGID CCCCOCCNC(=O)C(C)(C)C1CCCC1 161404558 USNNWVQVXGGBFG-UHFFFAOYSA-N 255.402 3.136 70 20 CGID CCCn1nccc1CNc1ccc2c(c1)OC(C)(C)O2 160010136 OLZJBGCMDYHACB-UHFFFAOYSA-N 287.363 3.413 70 20 CGID CCN(CC(C)(C)O)C(=O)C[C@H]1CCCCC1(C)C 160107267 DCQMXUKOWOKQLU-CYBMUJFWSA-N 269.429 3.212 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1 160133094 DCHQENAWTSJNPV-AEFFLSMTSA-N 288.435 3.013 70 20 CGID CCC(CC)(CC)CNC(=O)NCc1ncccc1F 160320569 QGRPLFXTFJKRPT-UHFFFAOYSA-N 281.375 3.236 70 20 CGID C[C@@H](CC(=O)NC[C@@H]1CCc2ccccc21)c1ccncc1 160539097 WBYKKIONYMRGED-YOEHRIQHSA-N 294.398 3.421 70 20 CGID C[C@H](CC(=O)NC[C@@H]1CCc2ccccc21)c1ccncc1 160539241 WBYKKIONYMRGED-PBHICJAKSA-N 294.398 3.421 70 20 CGID C[C@@H](C(=O)NCCc1ccccc1)c1c(F)cccc1F 160633399 QOFGASMVFGSADF-GFCCVEGCSA-N 289.325 3.427 70 20 CGID C[C@H](C(=O)N(C)Cc1ccco1)c1c(F)cccc1F 160835801 OQOGASIYRQAPDI-JTQLQIEISA-N 279.286 3.320 70 20 CGID CCOc1cc(F)ccc1NC(=O)NC[C@@H](C)SC 160962449 CDDHRXUEGGJLMN-SECBINFHSA-N 286.372 3.097 70 20 CGID CC[C@@H](CSC)NC(=O)Nc1ccnc(C)c1Cl 159679122 MRRZJQORXOTJIC-VIFPVBQESA-N 287.816 3.307 70 20 CGID CCOCCCN(Cc1ccccc1)C[C@@H]1CCCO1 159550347 GOKBEABJTDMSIE-KRWDZBQOSA-N 277.408 3.094 70 20 CGID CC[C@@H]1C[C@H](N[C@H](C)c2ccc(OC)cc2)CCO1 160086053 BDNIPWZKBZDBLZ-BPLDGKMQSA-N 263.381 3.303 70 20 CGID C[C@H](NC(=O)CCNC(C)(C)C)C1CCCCCC1 160628573 NYDJXSZJEWLEMB-ZDUSSCGKSA-N 268.445 3.240 70 20 CGID Cc1cccc(C(=O)NC[C@@H]2Cc3ccccc32)c1F 161479464 AJGOGOYHCMVTSF-ZDUSSCGKSA-N 269.319 3.204 70 20 CGID C/C=C/COC(=O)c1ccc(OCC(C)C)c(OC)c1 217393419 GZABTCBBZQXXJW-AATRIKPKSA-N 278.348 3.463 70 20 CGID CC1(C)CCC(CC(=O)NC[C@@H]2CCN(C3CC3)C2)CC1 160140337 UCFBIFDYXKADPC-HNNXBMFYSA-N 292.467 3.193 70 20 CGID CN[C@@H]1CCN(C(=O)C[C@@H](C)c2ccc(C(C)C)cc2)C1 160538288 YSJMTDDVYQKWHO-RHSMWYFYSA-N 288.435 3.124 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccccc1OC 160584882 PQOBGWPTMUUGMZ-KBPBESRZSA-N 292.423 3.390 70 20 CGID CCN(C)C(=O)N[C@H](c1ccco1)c1ccccc1OC 160662697 GYWAAYJJPNALGF-HNNXBMFYSA-N 288.347 3.039 70 20 CGID COc1ccc(C)cc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 159640106 SRYSPERWAHAZIN-UAGQMJEPSA-N 287.403 3.051 70 20 CGID COC[C@H](Nc1nc(C(C)(C)C)ns1)c1ccco1 159860433 LGCBNZQTOKLZEG-VIFPVBQESA-N 281.381 3.228 70 20 CGID CC[C@@H]1CN(C(=O)Nc2ccnc(C)c2Cl)C[C@@H](C)O1 159902739 VYMIOFCHMHCWHP-MWLCHTKSSA-N 297.786 3.075 70 20 CGID CCC(CC)c1cc(C(=O)NCc2nc(C)cs2)on1 159777072 WUTHYDUBTMKPHW-UHFFFAOYSA-N 293.392 3.273 70 20 CGID CCOC(=O)CC1CCN(C(=O)[C@@H]2CCC[C@@H](C)C2)CC1 159984853 SXRKIEQLVKMQME-UKRRQHHQSA-N 295.423 3.005 70 20 CGID C[C@@H]1C[C@@H](C)CN(Cc2csc(C3CC3)n2)C1 161262315 JBYWRRFYIKGKSB-GHMZBOCLSA-N 250.411 3.498 70 20 CGID COc1c(C)cnc(CN(C)c2ccc(F)cc2)c1C 216712712 FCOZWRIJPSPIBC-UHFFFAOYSA-N 274.339 3.483 70 20 CGID COC(=O)c1csc(NC(=O)N(C)CC(C)(C)C)c1 161063683 HBMSTKYAPRPWHK-UHFFFAOYSA-N 284.381 3.045 70 20 CGID C[C@](O)(CNc1cccc(F)n1)c1ccccc1Cl 160163853 HTNYLAAUQGWEIV-AWEZNQCLSA-N 280.730 3.194 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1cccc(F)c1 160168551 SOBURPARLCLMBW-AWEZNQCLSA-N 277.339 3.047 70 20 CGID CCCCCNC(=O)N1C[C@H](c2ccsc2)O[C@H](C)C1 160177228 HNJCJGSNHYBZJU-TZMCWYRMSA-N 296.436 3.410 70 20 CGID CSC[C@@H](CCO)N[C@@H](Cc1ccc(F)cc1)C(C)C 160279428 GEWWQTLFNJEYHO-CVEARBPZSA-N 299.455 3.096 70 20 CGID O=C(Cc1cccc(OC(F)(F)F)c1)Nc1ccccn1 160373609 XCKHWVUSVRTIFM-UHFFFAOYSA-N 296.248 3.161 70 20 CGID COC(CN1CCCCC[C@@H]1c1ccccc1)OC 160622010 RVECDINHOKTEON-OAHLLOKOSA-N 263.381 3.223 70 20 CGID c1ccc([C@@H]2C[C@@H](Nc3ccccn3)CCO2)cc1 160629723 RWAGVDPTYJPTOJ-GJZGRUSLSA-N 254.333 3.414 70 20 CGID C[C@@H](CCn1cccn1)Nc1ccc2ncccc2c1 159403612 KIBFHCVKTVUZKA-ZDUSSCGKSA-N 266.348 3.322 70 20 CGID CC(C)(C)c1nsc(N[C@H](CCO)c2ccccc2)n1 159608127 WGGIHKVREFIFAE-GFCCVEGCSA-N 291.420 3.371 70 20 CGID CN(C)CC(=O)N[C@@H](c1cccc(Cl)c1)C1CCCC1 159809000 KKOYIMDJXFOIKN-MRXNPFEDSA-N 294.826 3.249 70 20 CGID CC(C)[C@@H]1OCC[C@@H]1CNc1nc(C(C)(C)C)ns1 159839343 IORAEQFRHMWXEW-MNOVXSKESA-N 283.441 3.309 70 20 CGID CCC[C@H](C)CC(=O)N[C@@H]1CCOC2(CCCC2)C1 159662258 LAPFKBDZJBRPRF-UONOGXRCSA-N 267.413 3.421 70 20 CGID O=C(Cc1cccc(OC(F)F)c1)NCC1(C2CC2)CC1 159690419 VJOFOQQQKUETBQ-UHFFFAOYSA-N 295.329 3.137 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(C)c(C)c1 159740725 ADJCBDSAHJDSNG-UHFFFAOYSA-N 278.396 3.224 70 20 CGID Cc1cccc(C(=O)N[C@H]2CCCc3cc(N)ccc32)c1 159365237 OLXNARXRPZZCOW-KRWDZBQOSA-N 280.371 3.385 70 20 CGID Fc1ccc2c(c1)[C@@H](N[C@@H]1CCCSC1)CC2 159595684 QGPBOZWJPDDPJN-OCCSQVGLSA-N 251.370 3.298 70 20 CGID Cc1nc2ccccc2nc1N[C@H]1CCOC(C)(C)C1 160676216 XKPZUYDYFNMDPD-LBPRGKRZSA-N 271.364 3.308 70 20 CGID CC(C)(C)[C@@H]1CCN(C(=O)Nc2ccc(CN)cc2)C1 160979368 FQYCZVHVMQDYJU-CYBMUJFWSA-N 275.396 3.045 70 20 CGID CCNCC1CCN(C(=O)c2sccc2C(C)C)CC1 161030338 VUIFYGYRBPPYGU-UHFFFAOYSA-N 294.464 3.333 70 20 CGID c1cc2occc2c(N[C@@H]2CCO[C@@H](C3CC3)C2)n1 160322678 SVPZOVFSQFHIKI-BXUZGUMPSA-N 258.321 3.197 70 20 CGID CC[C@H](CC(=O)NCCCC(C)(C)CO)c1ccccc1 160358802 CLRDQWWJAJPYIX-OAHLLOKOSA-N 291.435 3.485 70 20 CGID CC1(C)CCC(C(=O)N2CC[C@H](CN3CCCC3)C2)CC1 160616024 GEGQBKFCOVWVSY-OAHLLOKOSA-N 292.467 3.147 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)Nc1cc(C(=O)OC)cs1 160629930 VBXKTWFQXDVQJE-GXSJLCMTSA-N 296.392 3.235 70 20 CGID CC1(C)C[C@H](Nc2c(F)c(F)nc(F)c2F)CCO1 160650592 YAPKQKZTGZUBPP-ZCFIWIBFSA-N 278.249 3.008 70 20 CGID CC(C)CSCCCNC(=O)c1cc(C(C)C)nn1C 160730127 DFOHZYIDZIULLY-UHFFFAOYSA-N 297.468 3.053 70 20 CGID CC(=O)c1ccc(C(=O)NCCCSCC(C)C)cc1 160876521 ZIJOMBYNJBBREF-UHFFFAOYSA-N 293.432 3.398 70 20 CGID Cc1cccc(C)c1NC(=O)NCC(C)(C)[C@H](O)C(C)C 160953731 VINKJGGCBRATLU-OAHLLOKOSA-N 292.423 3.468 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)OCc1cccnc1 159409283 KLOOOHORKINUAM-STQMWFEESA-N 273.357 3.298 70 20 CGID CC(C)c1ccc(C(=O)N2CCc3ccccc32)cn1 159442187 HTBMEXCFAVVOKC-UHFFFAOYSA-N 266.344 3.408 70 20 CGID O=C(Nc1nc(-c2cccs2)cs1)[C@H]1CCCCO1 159670947 RWFUEMODJMYFDO-SNVBAGLBSA-N 294.401 3.379 70 20 CGID OCCN[C@@H](Cc1ccc(Cl)cc1)c1ccccc1 159709621 QLVYREVPDVNWIF-INIZCTEOSA-N 275.779 3.206 70 20 CGID Cc1cc2ccccc2nc1N[C@H]1CCN(C)[C@H](C)C1 160245876 DJIHPHSCTBATIJ-HIFRSBDPSA-N 269.392 3.438 70 20 CGID c1cc(CNCCOC2CCCC2)c2[nH]ccc2c1 218156470 QJPZVCJHKFQUDN-UHFFFAOYSA-N 258.365 3.217 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1nnc(C(C)C)s1 160230216 DXIZWXYCVAQMJN-PRHODGIISA-N 253.371 3.036 70 20 CGID CC(C)[C@@H](C)NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 160374919 RBSLJXBQJDIUHX-IUODEOHRSA-N 292.379 3.020 70 20 CGID CCc1cc(NC(=O)N2C[C@H](C)[C@H]2c2ccccc2)n(C)n1 160424257 NHLAUFLFMTUQQH-LRDDRELGSA-N 298.390 3.207 70 20 CGID CCOc1ccccc1C(=O)N(C)c1ccc2c(c1)OCO2 160623714 HDBHBZJTPMCCGT-UHFFFAOYSA-N 299.326 3.091 70 20 CGID C[C@H]1CCCN(CCCCNC(=O)[C@H]2CCC[C@@H](C)C2)C1 160634664 JVNILEALBWWLID-IKGGRYGDSA-N 294.483 3.441 70 20 CGID COC(C)(C)CNc1nc2ccc(F)cc2s1 160744523 FMICVIDHNSYKKP-UHFFFAOYSA-N 254.330 3.272 70 20 CGID C[C@H](CCC(=O)NC[C@@H]1CCC[C@H](O)C1)c1ccccc1 160771256 ZECAOZBOPODCRB-INMHGKMJSA-N 289.419 3.238 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cccc(-c2cnco2)c1 159636755 OUJSDZGOUZYCLG-LLVKDONJSA-N 274.320 3.095 70 20 CGID COc1ccc(CNC(=O)C2=C(C)OCCC2)cc1Cl 159853499 VJLBMLBUYYIEMK-UHFFFAOYSA-N 295.766 3.049 70 20 CGID CCC(CC)CN(CC)C(=O)NCCc1cscn1 159372350 QXUSQRNYEKRUJI-UHFFFAOYSA-N 283.441 3.153 70 20 CGID CCOC(=O)c1csc(N(C)C(=O)C(C)(CC)CC)n1 159388341 KDIZVBCEBVJSHM-UHFFFAOYSA-N 298.408 3.109 70 20 CGID CCCCO[C@@H]1C[C@@H](N[C@@H](C)c2cnccn2)C1(C)C 159779728 VGDHVDUZIMSQFN-NWANDNLSSA-N 277.412 3.111 70 20 CGID CCOCCCN(C)Cc1csc(Br)c1 159611217 VNMGLCXHVQNHGK-UHFFFAOYSA-N 292.242 3.369 70 20 CGID CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(Cl)cc1 159986524 LVAFHEKHTLUPFL-TUAOUCFPSA-N 282.815 3.294 70 20 CGID CC(C)[C@@H](CNCC1(O)CCCC1)c1ccccc1 218211051 TYTFCKNONHHHPE-MRXNPFEDSA-N 261.409 3.321 70 20 CGID COC[C@@H](C)NC(=S)N(CCC(C)C)CCC(C)C 217760343 AWLRQCSRAIFTMR-CQSZACIVSA-N 288.501 3.290 70 20 CGID Cc1cc(NC(=O)C[C@@H](C)c2c(C)noc2C)ccc1O 161108334 CJELZCCVSKSMDN-SNVBAGLBSA-N 288.347 3.438 70 20 CGID CC1=C(C(=O)N[C@H]2CCOC3(CCCCC3)C2)CCCO1 160149130 PZDREIDBYGRLNJ-AWEZNQCLSA-N 293.407 3.069 70 20 CGID Cc1cnc(SCC(=O)CCC2CCCC2)nc1 160321872 MTDHKXNKLPPGGB-UHFFFAOYSA-N 264.394 3.417 70 20 CGID Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cncnc2C)c1 160674666 IWMUMKABPQXLHQ-QGZVFWFLSA-N 295.386 3.379 70 20 CGID Cc1ccccc1CCCn1cnc(C(C)C)cc1=O 160776885 DDNAQXYXCSABKR-UHFFFAOYSA-N 270.376 3.308 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CCOc2ccccc21 159839268 NATPNQWHLOQUQH-YUELXQCFSA-N 273.376 3.248 70 20 CGID CN(C(=O)Nc1cccc(Cl)c1F)[C@H]1CCSC1 159656974 KSZWDFPVQJNPKU-QMMMGPOBSA-N 288.775 3.448 70 20 CGID Cc1ccc(Cl)c(OC(=O)[C@H]2CCCCO2)c1 159714615 HGVSIHNQTDDORH-LLVKDONJSA-N 254.713 3.123 70 20 CGID C[C@H]1CC=CC[C@@H]1COC(=O)Cc1ccsc1 218498690 BOZYGRWRYXHANC-WCQYABFASA-N 250.363 3.436 70 20 CGID COc1ccc(NC(=O)N2[C@H]3C=CC[C@H]2CC3)c(OC)c1 218755121 XQFJOGRHERTEFL-RYUDHWBXSA-N 288.347 3.029 70 20 CGID COC[C@H](C)CNc1ncc(Cl)cc1Br 159580730 WUZKDAHASHOSSP-SSDOTTSWSA-N 293.592 3.192 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2cc(C)on2)n1 159886485 PKVRJONTWWTADK-OAHLLOKOSA-N 257.337 3.024 70 20 CGID CC[C@@H](C)OC[C@@H](CS(=O)(=O)Cl)C(C)(C)C 114478372 LGKLWQAKOZVSKV-ZJUUUORDSA-N 270.822 3.032 70 20 CGID CCS[C@@H]1CCC[C@H]1Nc1ncnc2c1CCCC2 217811735 QRNKXZMRHSFBDW-ZIAGYGMSSA-N 277.437 3.442 70 20 CGID COc1cc(C)ccc1CNC(=O)NCc1ccccc1 161505435 ZUXDQXPNBABLIV-UHFFFAOYSA-N 284.359 3.003 70 20 CGID CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1CCCCO1 160041652 LWKANWQVMUAZRC-NSHDSACASA-N 287.812 3.319 70 20 CGID Cc1ccnc(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160534148 FGRKPZDXVAJXHK-LSDHHAIUSA-N 269.348 3.117 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 160811959 QRARFCNXRVBEOW-KNHMANMVSA-N 275.348 3.029 70 20 CGID C[C@H](CC(=O)N1CCSc2ncccc21)c1ccncc1 160818948 VOLWANSHUMZJTP-GFCCVEGCSA-N 299.399 3.109 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CCCCOC 160829404 GTWHXZUFBLVGPN-UONOGXRCSA-N 255.402 3.230 70 20 CGID C[C@@H]1COc2ccccc2N1Cc1cnc2ccccn12 160868214 NZDDZQWESMWWKB-CYBMUJFWSA-N 279.343 3.122 70 20 CGID CCc1cccc(CC)c1NC(=O)[C@@H]1CCCCO1 159601688 CGEKBLDFOJOKOB-AWEZNQCLSA-N 261.365 3.319 70 20 CGID O=C(CCc1ccsc1)N[C@H]1CCOC2(CCCC2)C1 159422953 XSKLNJVOYFVZBN-AWEZNQCLSA-N 293.432 3.289 70 20 CGID CCOC[C@@H]1CCCN(c2nc(C(C)(C)C)ns2)C1 159477913 UOJRLYDBLUGURB-LLVKDONJSA-N 283.441 3.089 70 20 CGID CC[C@@H](C)[C@@H](C)NC(=O)CSc1nc2ccccc2[nH]1 159777618 UIXCSOJKAYVWRK-GHMZBOCLSA-N 291.420 3.206 70 20 CGID CCCn1nccc1CN[C@@H](C)c1ccc(OC)cc1 160171819 YGVSTHFAANEQJW-ZDUSSCGKSA-N 273.380 3.153 70 20 CGID Nc1cccc(Cc2nc([C@@H]3CCCCS3)no2)c1 160651269 CYKCAHISONWWSE-LBPRGKRZSA-N 275.377 3.201 70 20 CGID C[C@@H](CCC(C)(C)C)NC(=O)[C@H](N)c1ccccc1 161230293 JZRLBZQNGZUOBV-GXTWGEPZSA-N 262.397 3.017 70 20 CGID CCCc1sc(C(=O)N2CCC(C)(O)CC2)cc1CC 161298879 PJSQBRLKBQDAGM-UHFFFAOYSA-N 295.448 3.250 70 20 CGID O=C(OC1CCCC1)c1cccc(OC[C@H]2CCCO2)c1 218476787 FXSXJJCSPBDRSO-MRXNPFEDSA-N 290.359 3.344 70 20 CGID Cc1ccc(C2CC(N[C@H]3CCN4CCCC[C@@H]34)C2)cc1 217691685 PNCSVKYGZHFYCK-BTRQGYIVSA-N 284.447 3.457 70 20 CGID C[C@H]1CCCC[C@H]1N(C)C(=O)CN(C1CCCC1)C1CC1 216859647 LVXQLQLYPLWLCS-WMLDXEAASA-N 292.467 3.431 70 20 CGID COCCCNC(=O)c1cc(Cl)cc(C(F)(F)F)c1 159685432 CVEHENNMKYSYBQ-UHFFFAOYSA-N 295.688 3.125 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1cncc(Br)c1 161412285 LRVKJGQZRRHNLW-NSHDSACASA-N 287.201 3.053 70 20 CGID C/C(=C\C(=O)Nc1ccc(S(=O)(=O)F)cc1)C(C)(C)C 776364005 OHNMWFWTDVBEGP-MDZDMXLPSA-N 299.367 3.276 70 20 CGID CCOCCSCc1noc(C2CCCCC2)n1 159850573 PZVNLSQENHILHL-UHFFFAOYSA-N 270.398 3.387 70 20 CGID CCC(CC)c1noc(S(=O)(=O)Cl)c1Cl 521400262 CLDGYWUYMVQPHQ-UHFFFAOYSA-N 272.153 3.159 70 20 CGID CCNCC1CCN(C(=O)C[C@H]2CCC[C@@H](C)C2)CC1 161088851 UDJCHVAVHMXIDB-ZBFHGGJFSA-N 280.456 3.051 70 20 CGID COc1ccc(NC(=O)c2ccnn2C(C)C)c(C)c1 161259352 GFKJCPZIPHEHOG-UHFFFAOYSA-N 273.336 3.033 70 20 CGID CC[C@H](CO)N[C@H](CC)c1cccc(Cl)c1F 161480212 VNQCNNNUMDJNMV-BXKDBHETSA-N 259.752 3.291 70 20 CGID COC[C@H](NC(=O)Nc1cccc2ccc(C)nc12)C1CC1 160109856 CFGHDTNCZSZERV-HNNXBMFYSA-N 299.374 3.090 70 20 CGID Cc1c(Br)cccc1CS[C@@H](C)CO 160154828 NNNGSJQGTBMSMD-QMMMGPOBSA-N 275.211 3.372 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N(C)Cc1ccncc1 160336472 UESBNHFAJDBONE-KGLIPLIRSA-N 286.400 3.214 70 20 CGID CC[C@@H](C)Oc1ccc(C(=O)NCC(N)(CC)CC)cc1 160519742 GLWYJWKTBKAZBB-CYBMUJFWSA-N 292.423 3.111 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CSc1nncs1 160901808 FJMRXNPYTCDFFV-GHMZBOCLSA-N 299.465 3.057 70 20 CGID C[C@@H]1CC[C@@H](CCC(=O)N2CCc3c(F)cccc3C2)O1 160977302 QURJGRFMHMBNME-OCCSQVGLSA-N 291.366 3.058 70 20 CGID CCOc1ccc(NC(=O)[C@@H]2C[C@]2(C)CC)cc1OC 159842572 RIAWYXCQTWXBIY-LRDDRELGSA-N 277.364 3.469 70 20 CGID CNC(=O)c1cccc(CCN[C@@H](C)c2ccccc2C)c1 159667846 ISPDUZXFFMQRQD-HNNXBMFYSA-N 296.414 3.248 70 20 CGID CCCC1(CNC(=O)NCCCOCC2CC2)CCC1 159379334 DXWACFQMTIVWLB-UHFFFAOYSA-N 282.428 3.073 70 20 CGID COC(C)(C)CNC(=O)c1cc(Cl)c2ccccc2n1 160174892 PFWZKELXZWEACU-UHFFFAOYSA-N 292.766 3.043 70 20 CGID Cc1cc(C)n(CCCNCc2ccc(Cl)cc2F)n1 160897742 STUHZPRCFWMFPH-UHFFFAOYSA-N 295.789 3.472 70 20 CGID CC(C)(C)C1=CCN(C(=O)Cc2ccccc2O)CC1 160990561 YODQVNDZJKAFSC-UHFFFAOYSA-N 273.376 3.140 70 20 CGID O=C(N[C@@H]1CCCC[C@H]1O)c1cc2ccc(F)cc2s1 161192023 JFVBPKWDPQMJAJ-VXGBXAGGSA-N 293.363 3.074 70 20 CGID CC(C)c1ccc(CN(C)Cc2csnn2)cc1 160668587 XQSBPOQNSCHKTQ-UHFFFAOYSA-N 261.394 3.294 70 20 CGID CC(C)C[C@@H]1CCN(CCCN2CCCCC2)C1 161348099 NOGBAABWYMGNAD-INIZCTEOSA-N 252.446 3.230 70 20 CGID F[B-](F)(F)C1=C[CH-][CH]C=C1I 1565504620 WJWQDJJFXAAHJT-UHFFFAOYSA-N 270.808 3.040 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cccc(COC(C)C)c1 161299013 UVJVCPBKVFQKAK-CYBMUJFWSA-N 279.380 3.365 70 20 CGID Cc1cc(CNC(=O)C[C@@H](C)c2ccc(F)cc2F)on1 161433078 OVKCPIHBOSCTHM-SECBINFHSA-N 294.301 3.071 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@H]1c1c(F)cccc1F 160089989 OYMHLNMUUIRKTP-NEPJUHHUSA-N 291.341 3.375 70 20 CGID CSCCN(C)C(=O)NCC1(Cc2ccccc2)CC1 160816258 WGIQDWQXCICLCC-UHFFFAOYSA-N 292.448 3.014 70 20 CGID Cc1nn(-c2ccccc2)c(C)c1CN[C@H](C)[C@H]1CCOC1 159837058 GMDYPGQBVSVFAT-CJNGLKHVSA-N 299.418 3.004 70 20 CGID CC(C)(C)[C@H](N)C(=O)Nc1cc(C2CCCCCC2)[nH]n1 159478727 UPKXSLQNJQDHPS-CQSZACIVSA-N 292.427 3.159 70 20 CGID CC(C)[C@@H](Cc1ccccc1)C(=O)N1CCOC(C)(C)C1 159746632 XMMKROYYOKBUNM-MRXNPFEDSA-N 289.419 3.139 70 20 CGID COc1cc(NC(=O)N2CCC[C@@H](C)C2)ccc1F 160230097 QRBYBYNTOYEKNB-SNVBAGLBSA-N 266.316 3.098 70 20 CGID CCC(CC)(CN)C(=O)Nc1ccc(COC(C)C)cc1 161189861 CZBBXCFARNUGLN-UHFFFAOYSA-N 292.423 3.315 70 20 CGID CC(=O)NC1CCC(NCCCCC(C)(C)C)CC1 161447782 KNJNFIRTQBYJLN-UHFFFAOYSA-N 268.445 3.240 70 20 CGID C[C@@H](CC(=O)NCCc1cccc(O)c1)c1ccccc1 160163193 BPXMMVHHYVYSPZ-AWEZNQCLSA-N 283.371 3.245 70 20 CGID C[C@@H](C(=O)N[C@H]1CCc2c(O)cccc21)c1cccs1 160234879 SGFGLJPMHWHCAQ-MFKMUULPSA-N 287.384 3.361 70 20 CGID O=C(CCC(F)(F)F)N[C@@H]1CCOC2(CCCCC2)C1 160315815 FKNLONMSYIVYEK-LLVKDONJSA-N 293.329 3.327 70 20 CGID CCCC[C@@H](CC)CC(=O)N[C@@H](CCO)C(C)C 160561668 RCNFUDPAVXBSLW-KGLIPLIRSA-N 257.418 3.116 70 20 CGID C[C@H](CC(=O)N1CCc2ccccc2CC1)c1ccncc1 160631685 YJAWQAWMFXCTHF-OAHLLOKOSA-N 294.398 3.203 70 20 CGID COC(=O)c1cccc(OCc2ccc(Cl)cn2)c1 159526339 BSZMIZNXOACMOL-UHFFFAOYSA-N 277.707 3.101 70 20 CGID CC(C)[C@@H](O)CNC(=O)c1ccccc1Oc1ccccc1 159763751 PXBMLYPZZVLQCF-INIZCTEOSA-N 299.370 3.226 70 20 CGID COc1cc(N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)ccc1F 159975176 DMGCHMZMVFHZTO-DFBGVHRSSA-N 279.355 3.450 70 20 CGID Cc1cccc([C@@H](C)N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 160143067 BLCMZPHUZURCFN-BVUBDWEXSA-N 259.393 3.459 70 20 CGID Cc1nc2ccccn2c1CNC(C)(C)c1nccs1 160476430 IZZSTODEULKNTH-UHFFFAOYSA-N 286.404 3.124 70 20 CGID Cc1ccc(C(=O)N2CC=C(C(F)(F)F)CC2)c(O)c1 160600871 PWCOURYLTABZCV-UHFFFAOYSA-N 285.265 3.035 70 20 CGID CC[C@H](N)C(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 161235832 YSVBYXLBMKNCOI-VNQPRFMTSA-N 274.408 3.032 70 20 CGID CSc1ccsc1C(=O)N1[C@H](C)CC[C@H]1C 161497865 IGDWSVSPHIXECO-RKDXNWHRSA-N 255.408 3.483 70 20 CGID CC[C@@H]1C[C@H](C(=O)N[C@@H]2CCCc3sccc32)CCO1 160012551 IAVVYPOCLGWQCA-YRGRVCCFSA-N 293.432 3.447 70 20 CGID CSC[C@H](CCO)N[C@H](CCc1ccccc1)C(C)C 160350649 AORYMRAEGVOEQO-DLBZAZTESA-N 295.492 3.347 70 20 CGID CC(C)(C)c1nnc(N[C@H]2CCO[C@@H](C3CC3)C2)s1 160473081 NHNPGHWJQWFJBF-WDEREUQCSA-N 281.425 3.205 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@H]1CCCOc2ccccc21 160578229 KECYJUHXSHVDIJ-KBMXLJTQSA-N 275.392 3.041 70 20 CGID Cc1cc([C@@H](C)NC(=O)N2CCO[C@H](C)[C@@H]2C)c(C)s1 159833435 XVHSSKSHPXOPJW-GRYCIOLGSA-N 296.436 3.245 70 20 CGID Cc1ccc([C@H](C)NC(=O)Cc2c(C)noc2Cl)cc1 159844243 MJVBJWMUSXZZSH-JTQLQIEISA-N 292.766 3.365 70 20 CGID CCOCCC1(CNC(=O)C[C@@H]2CC[C@H](C)C2)CC1 159477115 PTKDCQGAJGMWTA-UONOGXRCSA-N 267.413 3.136 70 20 CGID CCSCC[C@@H](C)NC(=O)C[C@@H]1CNc2ccccc21 160227775 DQCPERHEMMFCKT-CHWSQXEVSA-N 292.448 3.234 70 20 CGID CCc1nc(CN[C@@H](CC(C)C)c2ccccc2)n[nH]1 160274399 XDMITWWFHPABQF-AWEZNQCLSA-N 272.396 3.244 70 20 CGID COc1cc(NCc2nccn2C(F)F)ccc1F 160291431 ANONBJIUFJUKAZ-UHFFFAOYSA-N 271.242 3.038 70 20 CGID CC(C)Sc1ccccc1NC(=O)C[C@@H]1CCCN1 160348073 CLAWSKFKJFOXPE-LBPRGKRZSA-N 278.421 3.268 70 20 CGID COC(=O)c1sccc1CSc1ccncc1 160038752 UNYYDKHTLAAULU-UHFFFAOYSA-N 265.359 3.222 70 20 CGID Cc1nc2c(s1)[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)CCC2 161103058 JFIRFARKVNFTQW-IPYPFGDCSA-N 293.480 3.291 70 20 CGID CC[C@@H](C)NC(=O)c1cccc(CN[C@H](C)C2(C)CC2)c1 161117433 LFIYNVCVWHBCRE-ZIAGYGMSSA-N 288.435 3.493 70 20 CGID CC(C)CCOc1ccc(NC(=O)CCNC(C)C)cc1 161381896 WYRJQQZJQCSUBZ-UHFFFAOYSA-N 292.423 3.438 70 20 CGID Cc1ccc2ncn(CC(=O)CCC3CCCC3)c(=O)c2c1 160311886 MJJHCRYPFMUCNM-UHFFFAOYSA-N 298.386 3.244 70 20 CGID C[C@@H](NCc1ccccc1CN1CCOCC1)C(C)(C)C 160488504 MNAWCJGPJZMSAO-OAHLLOKOSA-N 290.451 3.043 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(N(C)C)c(Cl)c1 160512637 CNDZREDWSZZQPR-VIFPVBQESA-N 286.828 3.486 70 20 CGID CCCC1(CNC(=O)c2cccc(-n3cccn3)c2)CC1 160701085 BELHTOIYYMQSNF-UHFFFAOYSA-N 283.375 3.182 70 20 CGID CCC(C)(C)NC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 160913929 ROZJKXQXPMACJY-GJZGRUSLSA-N 290.407 3.395 70 20 CGID Cc1cccc(NC(=O)NCCCC(=O)OC(C)C)c1C 160933471 OKVKZNZKUBBIFG-UHFFFAOYSA-N 292.379 3.157 70 20 CGID Cn1cnnc1CSc1ccc2ccccc2c1 160935088 JPORLXKRZLWEKV-UHFFFAOYSA-N 255.346 3.261 70 20 CGID Cc1ccc(F)c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c1 159691776 VYETZAVXAYWGCP-CYBMUJFWSA-N 291.366 3.356 70 20 CGID c1cnc2c(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)cccc2c1 159541165 PBTNIFNJNDYMIP-NXHRZFHOSA-N 294.398 3.282 70 20 CGID CCC[C@@H]1CN(C(=O)NCc2ccc(CC)s2)CCO1 159790667 BTLPVVLMJDKIAX-GFCCVEGCSA-N 296.436 3.021 70 20 CGID CCCCCC(=O)N[C@H](CC)c1c(C)noc1C 159995745 RETFMADDSOBAHE-GFCCVEGCSA-N 252.358 3.439 70 20 CGID CCC(CC)(CO)CN[C@H](C)c1ccccc1OC 161323883 BGHCQRRILDECDJ-CYBMUJFWSA-N 265.397 3.145 70 20 CGID COC(=O)CCCN(CCc1ccccc1)C1CCCC1 217223760 ISNUEPWIDQHCPU-UHFFFAOYSA-N 289.419 3.427 70 20 CGID CC(C)(C)c1csc(NC(=O)NCC(F)(F)F)n1 160416511 LSKPYRCVKFLXCA-UHFFFAOYSA-N 281.303 3.124 70 20 CGID CN(Cc1cccc(Cl)c1)C[C@@H](O)Cc1ccccc1 218689061 DKNODIFYNXGCHE-KRWDZBQOSA-N 289.806 3.375 70 20 CGID Fc1ccc(Cl)cc1NCc1nnc2n1CCCC2 217318012 OYTGRYJITNREDS-UHFFFAOYSA-N 280.734 3.019 70 20 CGID CCc1ncnc(NCCc2ccccc2C)c1F 217958608 UOYHRGYGZHJWBP-UHFFFAOYSA-N 259.328 3.141 70 20 CGID CN(C)[C@@H]1CCC[C@@H](N[C@@H](Cc2ccccc2)C2CC2)C1 161013288 GKOULCFFAWKDSW-QRVBRYPASA-N 286.463 3.470 70 20 CGID CC(C)NCCC(=O)N1CC2(CCCC2)c2ccccc21 161013625 RNOALTWLKURQRP-UHFFFAOYSA-N 286.419 3.233 70 20 CGID CCc1ccc(/C=C/C(=O)N2CCOC3(CCCC3)C2)o1 161190921 IFWQENNFRBUPLK-BQYQJAHWSA-N 289.375 3.027 70 20 CGID CC[C@@H](C)CN(CC)C(=O)C[C@H](C)c1ccncc1 161243823 SHVWMLPPQODNBM-KGLIPLIRSA-N 262.397 3.470 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)N[C@@H](C)CC(C)C 161297245 YUIFKIDNHGJXNA-MNOVXSKESA-N 266.385 3.336 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1oc(C)nc1C 161322842 VZBNSVKTWBOXEE-CHWSQXEVSA-N 264.369 3.332 70 20 CGID CC(C)(C(=O)NCc1nccn1C(F)F)C1CCCC1 161454055 LMMPIDXQMHKDRO-UHFFFAOYSA-N 285.338 3.111 70 20 CGID Cc1nnc(N[C@H]2CCO[C@@H](c3ccccc3)C2)s1 160534652 DSVUCCCNHMYZDG-QWHCGFSZSA-N 275.377 3.179 70 20 CGID CCCC[C@H](CC)CC(=O)N[C@H](CO)CC(C)C 160642660 AQCCKRMQHZCLDQ-KBPBESRZSA-N 257.418 3.116 70 20 CGID CCCCCOCC(=O)N[C@@H]1CCOC2(CCCCC2)C1 160806784 CGWKVBQWWUDJSK-OAHLLOKOSA-N 297.439 3.191 70 20 CGID COc1ccc(N[C@@H](C)CCn2cccn2)c(C)c1 159405963 VCMNATSQBGPJQU-ZDUSSCGKSA-N 259.353 3.091 70 20 CGID CN(CCC(F)(F)F)C(=O)/C=C/c1ccc(Cl)nc1 159438125 JFAPYFMTXICAOV-HWKANZROSA-N 292.688 3.159 70 20 CGID C[C@H]1CN(C[C@@H]2CCCN2CCC2CCCC2)C[C@@H](C)O1 159637484 FKKDDIHVPQFLIU-JZXOWHBKSA-N 294.483 3.140 70 20 CGID CC[C@H](Nc1ccc(N(C)C(C)C)c(F)c1)C(=O)OC 159493322 JEHDEEMAQBXQNL-ZDUSSCGKSA-N 282.359 3.034 70 20 CGID COc1ccc2c(c1)[C@H](N[C@H]1CCOC(C)(C)C1)CC2 159926480 XFNHYXJLUSFEMZ-XJKSGUPXSA-N 275.392 3.230 70 20 CGID COc1cc(NC(=O)c2ccc(Cl)cc2O)ccc1F 160407595 XHODJPZUWOKVRK-UHFFFAOYSA-N 295.697 3.446 70 20 CGID CCOCCCNC(=O)Nc1c(F)cccc1Cl 217313059 OGLFBEZTGZPGEF-UHFFFAOYSA-N 274.723 3.027 70 20 CGID Cc1ccccc1OCCCNC(=O)N1CCC[C@H](C)C1 217300380 SUHRIUZASQAACE-AWEZNQCLSA-N 290.407 3.205 70 20 CGID CCCOCC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 160136401 QXFHBVZZVFHYAQ-GOSISDBHSA-N 298.386 3.022 70 20 CGID CC[C@H](NC(=O)c1cccc(F)c1F)c1c(C)noc1C 160192801 YWYYQOXXBVWOHK-LBPRGKRZSA-N 294.301 3.451 70 20 CGID CCOCCCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160244793 NVVMBJSBIPZWBS-LBPRGKRZSA-N 291.269 3.045 70 20 CGID FC(F)(F)c1ccc(N[C@H]2CCO[C@@H](C3CC3)C2)nc1 160308133 VLXYFIDOSZJNRK-NWDGAFQWSA-N 286.297 3.470 70 20 CGID CC(C)C[C@H](C)NC(=O)NCCc1ccc(Cl)nc1 160381269 NYOAKYHMEWGWFX-NSHDSACASA-N 283.803 3.011 70 20 CGID CCC1(C(=O)N(C)c2ccc3c(c2)OCO3)CCCC1 160456918 RPTONVXAHMAHMM-UHFFFAOYSA-N 275.348 3.349 70 20 CGID COc1cccc(CCCN2CCS[C@H](C)C2)c1 160582147 XBKUHODREKOKLT-CYBMUJFWSA-N 265.422 3.065 70 20 CGID O=C([C@@H]1CCCCO1)N1CCC[C@@H]1c1ccc(F)cc1 160622392 LHFCZRLRQIVOEP-CABCVRRESA-N 277.339 3.058 70 20 CGID CC1(C)C[C@H](Nc2cc(C(F)(F)F)ccn2)CCO1 160677342 KVRWUOFVQHDKTA-SNVBAGLBSA-N 274.286 3.470 70 20 CGID CCOc1ccc(NC(=O)[C@H]2C[C@@]2(C)CC)cc1OC 159842224 RIAWYXCQTWXBIY-MLGOLLRUSA-N 277.364 3.469 70 20 CGID CCc1ccc(CC(=O)N(Cc2cccnc2)C2CC2)cc1 159769453 KPCUICSOMOUPKB-UHFFFAOYSA-N 294.398 3.378 70 20 CGID CC[C@H](O)CN(Cc1ccccc1)c1ccnc(C(C)C)n1 161010617 JVLKEZMCGIIVCY-INIZCTEOSA-N 299.418 3.378 70 20 CGID CCCc1sc(C(=O)N[C@H]2CCC[C@@H](N)C2)cc1CC 161145201 KEXNEZSAUUMOTL-OLZOCXBDSA-N 294.464 3.263 70 20 CGID COC(=O)c1ccc(CSCCOC(C)C)s1 159772583 XAYOQQJCBIGGBP-UHFFFAOYSA-N 274.407 3.193 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCc1ccc(C)cc1 217315154 KBZGOFJVRQAODH-OAHLLOKOSA-N 260.381 3.469 70 20 CGID CCS[C@H]1CCC[C@H]1Nc1ncnc2c1CCCC2 217811798 QRNKXZMRHSFBDW-KGLIPLIRSA-N 277.437 3.442 70 20 CGID CC(C)NC(=O)CN[C@@H]1C[C@@H](C)C[C@@H](c2ccccc2)C1 161004904 DYOVGCXQOXDATP-USXIJHARSA-N 288.435 3.073 70 20 CGID Cc1n[nH]c(C)c1CN(C)CCOc1ccc(Cl)cc1 161165221 LKSURXPEXQHWRK-UHFFFAOYSA-N 293.798 3.191 70 20 CGID C[C@H](N[C@@H]1CCOc2c(Cl)cccc21)c1cnccn1 161279328 YCLLNLXLOUJZHN-GXFFZTMASA-N 289.766 3.304 70 20 CGID CCOc1ncccc1NC(=O)c1ccc(C(C)C)nc1 161411010 JZCMITLFCUJZFP-UHFFFAOYSA-N 285.347 3.251 70 20 CGID O=C(Nc1ccc(Cc2ccncc2)cc1)[C@@H]1CCCCO1 160518399 UDTGYKQFQXQYNM-KRWDZBQOSA-N 296.370 3.180 70 20 CGID CC[C@@H](NC(=O)C[C@@H](C)c1ccncc1)c1ccncc1 160784693 LKFSKDAOEQPGOM-CZUORRHYSA-N 283.375 3.238 70 20 CGID CSCCNC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 159457085 GJGKXHUWUJOWJU-JHJVBQTASA-N 255.427 3.072 70 20 CGID CCO[C@H](CCNC(=O)c1ccc(Cl)nc1C)C(C)C 159652206 QTOSHOFWTSRURX-CYBMUJFWSA-N 298.814 3.224 70 20 CGID CCc1noc(C)c1CNc1cc(NC(C)=O)ccc1F 159371863 DREPFAPRFQXTAX-UHFFFAOYSA-N 291.326 3.255 70 20 CGID C[C@@]1(NC(=O)Nc2cccc(Cl)c2Cl)CCOC1 159377900 AJKRARLUBNLNLA-GFCCVEGCSA-N 289.162 3.294 70 20 CGID O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1cccc(F)c1 159663306 IEOPKQYJNSEORJ-WFASDCNBSA-N 276.355 3.029 70 20 CGID Cc1nn(C)cc1CNC[C@@H](c1ccccc1)C(C)C 159851305 WDUXNOMYMGJTHU-QGZVFWFLSA-N 271.408 3.258 70 20 CGID CC[C@@H](C)N(C)CCNCc1cc2ccccc2o1 217400759 RTULROWOEVXWLR-CYBMUJFWSA-N 260.381 3.253 70 20 CGID CC[C@@H](C)OCC(=O)NCc1oc2ccc(F)cc2c1C 161282463 HQJGWUMTMXSGQT-SNVBAGLBSA-N 293.338 3.312 70 20 CGID C[C@@H]1CCN(C(=O)NCc2cc3ccccc3[nH]2)C[C@@H]1C 161292607 YPMZJVXTBYGYPY-OLZOCXBDSA-N 285.391 3.355 70 20 CGID CC[C@H](NCCN(C)Cc1ccc(F)cc1)C1CC1 160142225 GBUWHDFASOQBHK-INIZCTEOSA-N 264.388 3.036 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1nnc(C(C)C)s1 160230589 DXIZWXYCVAQMJN-UFBFGSQYSA-N 253.371 3.036 70 20 CGID Cc1cccc(CCNC(=O)c2cnn(CC(C)C)c2C)c1 160573182 SFXFCMPCGXWSBV-UHFFFAOYSA-N 299.418 3.128 70 20 CGID CC(C)c1cc(=O)n(Cc2ccccc2OC(F)F)cn1 160658178 VSEMMKZIXJBKII-UHFFFAOYSA-N 294.301 3.016 70 20 CGID CC(C)c1cc(C(=O)N(C)C(C)C)nn1-c1ccccc1 160670605 CVVXIKVAKYWFKF-UHFFFAOYSA-N 285.391 3.476 70 20 CGID CCC(CC)n1nccc1C(=O)N[C@@H](C)c1cccnc1 160672164 DEBAPXFQLGSTSC-LBPRGKRZSA-N 286.379 3.130 70 20 CGID CC(C)[C@H](O)CCNC(=O)CC[C@@H](C)c1ccccc1 160836138 LGEAHNDFORCLTM-GDBMZVCRSA-N 277.408 3.094 70 20 CGID CC(C)n1cccc1C(=O)NCC(C)(C)N1CCCCC1 160906279 CGTXRFVMQFTLGV-UHFFFAOYSA-N 291.439 3.063 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccnc(N(C)C)c1 160925741 IDXFQHRQUDFAJD-UKRRQHHQSA-N 289.423 3.188 70 20 CGID C[C@@H](Sc1ccncc1)C(=O)Nc1ccccc1 159890095 IREHRPSOKYIWRB-LLVKDONJSA-N 258.346 3.201 70 20 CGID Fc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1F 159514538 JJMIWIWAGURYAO-UGFHNGPFSA-N 279.330 3.012 70 20 CGID COc1cccc(CNC(=O)c2ccc(C(C)C)nc2)c1 159712509 TWHXNQVMMGNCCF-UHFFFAOYSA-N 284.359 3.144 70 20 CGID C[C@@H](C(=O)Nc1cccc([S@](C)=O)c1)c1ccsc1 159740570 QASIKKXOBLFVLL-GIGQVBGESA-N 293.413 3.228 70 20 CGID COc1ccc(N(C)C(=O)c2cccs2)cc1F 159392726 OKYQCNHENTXLBT-UHFFFAOYSA-N 265.309 3.172 70 20 CGID CC(C)(C)C[C@H](CO)Nc1nc(C(C)(C)C)ns1 160041386 MRCSBVXRMLVDEO-SECBINFHSA-N 271.430 3.045 70 20 CGID CC1(C)C[C@@H](NCc2cccc3[nH]ccc23)CCO1 160525024 GZEMYMWINIGUCX-ZDUSSCGKSA-N 258.365 3.215 70 20 CGID C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@H]1CCCCO1 161094479 GRZZARMWRNBWGF-SMDDNHRTSA-N 281.783 3.429 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@H](C)Cc1cccc(Cl)c1 161150404 PBQGMWRXLGYZJF-DOMZBBRYSA-N 297.826 3.042 70 20 CGID CC1(NC(=O)N[C@H](Cc2ccccc2)C2CC2)CCC1 161393569 VNPWBWSXIFUGLC-OAHLLOKOSA-N 272.392 3.250 70 20 CGID COc1ccc(CN(C)C(=O)c2cccc(C)c2F)cc1 161398802 NWBZYSVHFYMQOJ-UHFFFAOYSA-N 287.334 3.415 70 20 CGID O=C(CCc1nc(C2CCCCC2)no1)NC1CCCC1 161452682 CEBLUBADAMZCQJ-UHFFFAOYSA-N 291.395 3.109 70 20 CGID CCc1ccccc1C(=O)N(C)c1ccc2c(c1)OCO2 160092685 NMUQQFHNQWCTSS-UHFFFAOYSA-N 283.327 3.254 70 20 CGID O=C(CCC1CCC1)N[C@@H]1CCOC2(CCCC2)C1 160149467 AJMMWOIUKDMLON-CQSZACIVSA-N 265.397 3.175 70 20 CGID CCc1nc(CN[C@H](C)c2cccc(OC(C)C)c2)n[nH]1 160317232 MKRQRMNIMWCZSW-GFCCVEGCSA-N 288.395 3.005 70 20 CGID CN(Cc1ccsc1)C(=O)N1CCCCCC1 160358171 FSVWVWNPXXHCCK-UHFFFAOYSA-N 252.383 3.176 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccccc1F 160390280 KCXATCHSLHNTRI-ZDUSSCGKSA-N 291.366 3.437 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)[C@H]1CC=CCC1 160873786 NOGKDKDSRLIYBO-NEPJUHHUSA-N 277.389 3.182 70 20 CGID CCC[C@@H](CCc1ccccc1)NC(=O)CC1(N)CCC1 160939122 RWGALODEEMSDLN-INIZCTEOSA-N 288.435 3.176 70 20 CGID Cc1cccc(N(C)Cc2nccn2Cc2ccccc2)n1 159708433 SOCXRUZTKRJGEW-UHFFFAOYSA-N 292.386 3.271 70 20 CGID C[C@@H]1SCCN(c2nc(C(C)(C)C)ns2)[C@@H]1C 159549918 DLGCYTNTLMPQPM-BDAKNGLRSA-N 271.455 3.166 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCCCCC1 161096523 IDUJYPHSZBZCJZ-UHFFFAOYSA-N 263.385 3.260 70 20 CGID CCCN(CCO)Cc1c(Cl)cccc1OC(F)F 161214656 GCTDSUVKMTUBIW-UHFFFAOYSA-N 293.741 3.146 70 20 CGID CN(CC1CCOCC1)c1nc(-c2ccccc2)ns1 161282614 CJKRIJDQFVSMKL-UHFFFAOYSA-N 289.404 3.068 70 20 CGID CC[C@@H](C(=O)NC[C@H](C)SC)c1ccc(F)cc1 161336537 MXFWRTXUIAKCGO-GXFFZTMASA-N 269.385 3.187 70 20 CGID CCC[C@H](C)C(=O)Nc1ccc(C(=O)NC)cc1Cl 160260115 YNKKQSCVPQFGLL-VIFPVBQESA-N 282.771 3.074 70 20 CGID C[C@H](N[C@H](CN1CCCC1=O)c1ccccc1)c1ccco1 160758549 AALOQMFCQJMTIZ-GOEBONIOSA-N 298.386 3.294 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)[C@@H](C)CC1CCCCC1 160850250 YSLMWSRRCOCZJE-STQMWFEESA-N 283.412 3.051 70 20 CGID CC(C)[C@@H](C)NC[C@@H](C)N1CCc2ccccc2C1 159800922 AIEPUUANOAXRBC-HUUCEWRRSA-N 260.425 3.067 70 20 CGID C[C@@H](C(=O)NCc1nc2ccccc2[nH]1)c1cccs1 159820907 IZZQTHXOYBOJED-SNVBAGLBSA-N 285.372 3.044 70 20 CGID Cc1ccc(C)c(-n2ncc(C(=O)NCC(C)C)c2C)c1 159495698 FZRACARPNDVXKD-UHFFFAOYSA-N 285.391 3.183 70 20 CGID COCCCCC(=O)N(C)c1ccc(OC)c(Cl)c1 159902479 KBVXWJFLAKUFGC-UHFFFAOYSA-N 285.771 3.128 70 20 CGID CC[C@H](NCCC(C)(C)O)c1nc(C(F)(F)F)cs1 159741699 ALBGKCCOPSRQTK-QMMMGPOBSA-N 296.358 3.364 70 20 CGID COc1ccc2cc(NC(=O)NC3CC=CC3)ccc2n1 159747915 DMYWTIVBKHCDMV-UHFFFAOYSA-N 283.331 3.084 70 20 CGID CCCN(Cc1ccccn1)[C@H](C)C(=O)Nc1ccccc1 159953576 NMSRQTRNNAYLEW-OAHLLOKOSA-N 297.402 3.321 70 20 CGID C1CCC(N2CCC(N[C@H]3CCCSC3)CC2)CC1 159522270 XDNBRNNXRKKQEM-HNNXBMFYSA-N 282.497 3.269 70 20 CGID Cc1cc(C)n(CCCNCc2ccc(F)c(Cl)c2)n1 159600136 ZZWMJJRJBVSZHI-UHFFFAOYSA-N 295.789 3.472 70 20 CGID COC(=O)C1(NCc2ccc(F)cc2Cl)CCCCC1 217096587 CPWDHMOVHUIQEI-UHFFFAOYSA-N 299.773 3.445 70 20 CGID COc1ccc(CN(C)Cc2scnc2C)c(OC)c1 160838736 HXYAPYQMCLCWNL-UHFFFAOYSA-N 292.404 3.101 70 20 CGID CCC(CC)(CO)CN[C@@H]1CCCc2ccccc21 161338556 VUGYBNGVPJWKBD-MRXNPFEDSA-N 261.409 3.452 70 20 CGID COCCN1CCC(c2ccc(Br)cc2)CC1 217258793 AYARBVOCBLYVAM-UHFFFAOYSA-N 298.224 3.275 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cscn1 161098712 XZUQOTZWXZXLPD-CMPLNLGQSA-N 252.383 3.184 70 20 CGID Cc1ccc([C@H](C)NCCc2ccc3c(c2)OCO3)o1 161150361 IKPYIEKVSHITCF-LBPRGKRZSA-N 273.332 3.210 70 20 CGID CCSCC[C@@H](C)NC(=O)Nc1ccc(C)nc1 161444379 PEAWUSRSYGONFI-LLVKDONJSA-N 267.398 3.043 70 20 CGID CCC1CCC(CNC(=O)N(C)C[C@H]2CCC[C@H]2O)CC1 160110211 RWKUIASZOVXCQN-QDIHITRGSA-N 296.455 3.005 70 20 CGID CC(C)(C)CC(C)(C)NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160280664 JJBOVQSPLZQHCY-KGLIPLIRSA-N 296.455 3.458 70 20 CGID CCCC1(CNC(=O)NC[C@@H](C)c2c(C)noc2C)CC1 160333485 RPMKPUWUECBJJT-LLVKDONJSA-N 293.411 3.274 70 20 CGID CC(C)c1ccc(C(=O)N[C@H](C)CNc2ccccc2)cn1 160396005 IXSLFXJAVRVSCH-CQSZACIVSA-N 297.402 3.435 70 20 CGID CC[C@@H](NCc1ccccc1CN1CCOCC1)C(C)C 160479059 HHPBMCNIIOCXNG-GOSISDBHSA-N 290.451 3.043 70 20 CGID CCC(CC)(CC)NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 160537188 PQMFLJLHGFGWPX-KBPBESRZSA-N 282.428 3.212 70 20 CGID O=C(Cc1ccsc1)NCCOc1ccccc1Cl 159449512 RWZUNTNEQBHHGH-UHFFFAOYSA-N 295.791 3.139 70 20 CGID COc1ccccc1-c1ccc([C@H](C)NCCO)cc1 159687304 UYCSPBKSJZDODX-ZDUSSCGKSA-N 271.360 3.005 70 20 CGID C[C@H](c1cccs1)N(C)C(=O)[C@H](O)c1ccccc1 159932949 YKCJRDRJWXFRGN-BXUZGUMPSA-N 275.373 3.001 70 20 CGID CO[C@]1(C)C[C@H](N(C)C(=O)c2cc(C(C)C)on2)C1(C)C 159747897 KZDUMBHLSJECLB-XJKSGUPXSA-N 294.395 3.074 70 20 CGID CCC(CC)(CC)CNC(=O)NC1C[C@@H](C)O[C@H](C)C1 159966711 BOVPNYRVEQCQPL-CHWSQXEVSA-N 284.444 3.458 70 20 CGID Cc1cc(OC(=O)[C@H]2CCCCO2)ccc1Cl 159585652 ADIMZBUONOZDRW-GFCCVEGCSA-N 254.713 3.123 70 20 CGID COc1ccc(CNc2ccc(F)c(OC)c2)cc1O 160015558 TUXCPRQNGSQOKK-UHFFFAOYSA-N 277.295 3.161 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)Cc1ccc(F)cc1 160111533 QYCIOMHYPJIESW-UONOGXRCSA-N 266.404 3.077 70 20 CGID CNCCC1CCN(C(=O)c2cccc(C)c2Cl)CC1 160393763 WPOCMRVFNBYKEQ-UHFFFAOYSA-N 294.826 3.110 70 20 CGID CCc1ncnc(NCCCN(C)C2CCCCC2)c1F 217966060 RFCRBRSBZJIXEB-UHFFFAOYSA-N 294.418 3.245 70 20 CGID CCCCOCCCNC(=O)c1ccc(C(C)C)nc1 161023752 YOECLFXVKJZCMN-UHFFFAOYSA-N 278.396 3.142 70 20 CGID O=c1[nH]c(N[C@@H]2CCCc3sccc32)nc2ccccc12 161064446 AOFZKQVMOAARBO-GFCCVEGCSA-N 297.383 3.474 70 20 CGID C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H]1CCCCO1 161094649 GRZZARMWRNBWGF-BXUZGUMPSA-N 281.783 3.429 70 20 CGID COC(=O)c1coc(COc2ccc3[nH]ccc3c2)c1 160057099 UJOAZHJLXWJSDL-UHFFFAOYSA-N 271.272 3.127 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cnc(-c2ccccn2)s1 160104653 RLBZAAQCFXODQD-UHFFFAOYSA-N 299.399 3.125 70 20 CGID CSC[C@H](CCO)N[C@@H]1CC[C@@H](C)c2ccccc21 160326060 JLNPAWSQCBBJRN-DVOMOZLQSA-N 279.449 3.329 70 20 CGID Cc1cccnc1NC(=O)Cc1c[nH]c2cc(F)ccc12 160339025 PCPKJKHXSJHOLT-UHFFFAOYSA-N 283.306 3.192 70 20 CGID CN(Cc1cccn1C)C(=O)c1cc2cc(F)ccc2o1 160402127 LDAZCMQYXAEHLX-UHFFFAOYSA-N 286.306 3.183 70 20 CGID CCC(C)(C)NC(=O)[C@H](C)Nc1ccn(CCC(C)C)n1 159886130 QIRULKBSLLMSLD-ZDUSSCGKSA-N 294.443 3.034 70 20 CGID CCOc1ccc(NC(=O)N[C@H](C)C2CCC2)cc1OC 159710864 MYDKKSITCKXADV-LLVKDONJSA-N 292.379 3.404 70 20 CGID Cc1cc(Cl)cc(C)c1CN1CCC(CC(N)=O)CC1 159730386 CAJFXLYYFMNNHD-UHFFFAOYSA-N 294.826 3.044 70 20 CGID CC(C)c1ccc(C(=O)N(C)Cc2ccco2)cn1 159934765 IBPQYGSGOCTNBV-UHFFFAOYSA-N 258.321 3.070 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H](C)c2cnccn2)C1(C)C 159779473 VGDHVDUZIMSQFN-AEGPPILISA-N 277.412 3.111 70 20 CGID CS[C@@H]1CCC[C@H](NC(=O)CCCn2cccc2)C1 159588044 JEWNLXPMSJSRKS-UONOGXRCSA-N 280.437 3.059 70 20 CGID CC[C@H](NC(=O)c1ccc(Cl)o1)c1c(C)noc1C 159999710 TZHZLFWRUMNEDH-VIFPVBQESA-N 282.727 3.419 70 20 CGID Cc1ccc(NC(=O)NCC2(CO)CCCC2)cc1Cl 160338234 SCHOPYNGLXFAPU-UHFFFAOYSA-N 296.798 3.323 70 20 CGID Fc1cc(Cl)ccc1CNC1CCN(C2CC2)CC1 160760753 VNTFYAMOJWYLKX-UHFFFAOYSA-N 282.790 3.196 70 20 CGID CCO[C@H](C)c1nccn1CCOc1cccc(OC)c1 161476248 RAPJOGKHGLFZRI-CYBMUJFWSA-N 290.363 3.068 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)c2ccsc2)o1 161484247 WDAXTOUVMCDKMN-ZDUSSCGKSA-N 291.372 3.465 70 20 CGID O=C(COc1ccc2[nH]ccc2c1)NCc1ccc(F)cc1 160044169 FAVKVAAMUOFLTQ-UHFFFAOYSA-N 298.317 3.002 70 20 CGID CCC1(CNC(=O)NCCc2ccc(C)nc2)CCCC1 160121860 GWILNPNJKGBFPK-UHFFFAOYSA-N 289.423 3.202 70 20 CGID CCc1nc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)n[nH]1 160291725 IPCOPHYWFSVDKR-SECBINFHSA-N 298.312 3.237 70 20 CGID CCc1ccc([C@H](C)NCc2nc(O)cc(CC)n2)cc1 160543164 DMUBMZQSZUXPIM-LBPRGKRZSA-N 285.391 3.158 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCc1ccccc1OC(F)F 160555029 NQCIGIHWBWDDMF-NHYWBVRUSA-N 283.318 3.340 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)c1nc2ccccc2o1 160724835 IRCWKHVJFXHKBY-BONVTDFDSA-N 258.321 3.227 70 20 CGID CN(CC1CCC1)C(=O)NCC1(Cc2ccccc2)CC1 160772094 DVLAFZSHHYPXIJ-UHFFFAOYSA-N 286.419 3.451 70 20 CGID CCCCOc1cccc(CN[C@@H](C)[C@H]2CCOC2)c1 160817883 RRMQXGJXUXDUFP-HOCLYGCPSA-N 277.408 3.380 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c(C)c1 160934411 NAEMHJUGDLDBRK-GOEBONIOSA-N 288.391 3.383 70 20 CGID COc1ccc(-c2noc([C@@H]3CCC(=O)C[C@H]3C)n2)cc1 160996349 BCBCYKFSOVQDHL-QMTHXVAHSA-N 286.331 3.218 70 20 CGID CSCc1ccc(NC(=O)NOCC(C)C)cc1 159939728 XDBZCXUWEBVHBM-UHFFFAOYSA-N 268.382 3.259 70 20 CGID CCOCCCN(Cc1cccc(F)c1)C1CC1 159400747 JUNWNFARJKXVHR-UHFFFAOYSA-N 251.345 3.217 70 20 CGID CCCn1cc(Nc2nc(C(C)(C)C)ns2)cn1 159689619 ZDVOMXUOHYGMEM-UHFFFAOYSA-N 265.386 3.186 70 20 CGID COC[C@@H](NC(=O)Nc1ccc(CSC)cc1)C1CC1 159939036 QFAAPQOQQXQONA-CQSZACIVSA-N 294.420 3.096 70 20 CGID C[C@@H](N[C@H]1CCOC(C)(C)C1)c1nc2ccccc2n1C 159935199 GRMKFTXSBIVWQK-OLZOCXBDSA-N 287.407 3.182 70 20 CGID CCc1nc(CN[C@H](C)c2ccc(F)cc2Cl)n[nH]1 160448052 TWFQKJLWJZUFNB-MRVPVSSYSA-N 282.750 3.010 70 20 CGID OCc1cccc(CNc2cc(Cl)nc(C3CC3)n2)c1 218007749 ZDEHGZZXNFJMDU-UHFFFAOYSA-N 289.766 3.112 70 20 CGID COCCC1(CNC(=O)N(CCC(C)C)C2CC2)CC1 161024764 QDKGBLDQJMAVNR-UHFFFAOYSA-N 282.428 3.023 70 20 CGID C[C@H](NC(=O)NO[C@H]1CCCCO1)c1ccccc1Cl 161234213 AJNQMOQMBNRSIZ-GWCFXTLKSA-N 298.770 3.158 70 20 CGID CCOC[C@@H]1CCCN(C(=O)/C=C/c2ccc(CC)o2)C1 160018910 POROQNSJXQGBNM-ATWMFIQVSA-N 291.391 3.130 70 20 CGID C[C@H](N[C@H](C)C1CC1)c1ccc(OCc2nccn2C)cc1 160118388 WUJDHRVYFBXOND-KGLIPLIRSA-N 299.418 3.448 70 20 CGID Cc1cc(F)ccc1NC(=O)N(C)CCc1nccs1 160122612 FTFLYMYTADTJIR-UHFFFAOYSA-N 293.367 3.297 70 20 CGID COc1cc(Cl)ccc1C(=O)NCC1(C2CC2)CC1 160162461 PZNWOQLPSVAHJU-UHFFFAOYSA-N 279.767 3.269 70 20 CGID CCC[C@H]1CN(C(=O)NCc2ccc(C)cc2C)CCO1 160176229 ZMFPMGTWFQIEIX-INIZCTEOSA-N 290.407 3.014 70 20 CGID CN(Cc1cccs1)C(=O)N1CCCCCC1 160357651 CZYNZFFBRKDOOV-UHFFFAOYSA-N 252.383 3.176 70 20 CGID Cc1ccc(-c2nnc(NC(=O)c3cccc(C)c3C)[nH]2)o1 160308539 VCMOCNWOINOYJW-UHFFFAOYSA-N 296.330 3.242 70 20 CGID Cn1cc(NC(=O)N2CCC(C)(c3ccccc3)CC2)cn1 160365557 GTBFGFGNAQMMDA-UHFFFAOYSA-N 298.390 3.006 70 20 CGID CCC(CC)(CC)NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160537060 PQMFLJLHGFGWPX-KGLIPLIRSA-N 282.428 3.212 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@@H](C)C[C@@H]1CCCO1 160669562 LWWKABRSQXZODX-AAEUAGOBSA-N 281.783 3.336 70 20 CGID COc1ccc(N(C)C(=O)[C@H](C)OCCC(C)C)cc1F 159838238 IFNVWUORKAZSOQ-LBPRGKRZSA-N 297.370 3.248 70 20 CGID CS[C@@H]1CCC[C@@H](NCc2ccccc2NC(C)=O)C1 160466097 KDLMHDFPPFWNNS-HUUCEWRRSA-N 292.448 3.409 70 20 CGID NC(=O)c1ccc(NCc2ccc(Cl)cc2F)cc1 160643682 DTJNTCSUCVZXCU-UHFFFAOYSA-N 278.714 3.190 70 20 CGID CCc1nc(NC(=O)N2CCCCC2)sc1C 160412960 PSVJUVLCZIFDND-UHFFFAOYSA-N 253.371 3.032 70 20 CGID CC(C)CNCc1ccccc1CNC(=O)OC(C)(C)C 218097197 BSTFGJIUDAJCFZ-UHFFFAOYSA-N 292.423 3.457 70 20 CGID CC[C@H](NCc1ccc(C)nc1)c1ccc2c(c1)OCCO2 161280027 NRLMZPAJHWRUPC-INIZCTEOSA-N 298.386 3.402 70 20 CGID COc1ccccc1CN(C)C(=O)c1cccc(C)c1F 161399339 UVCXVSCLXFFUAT-UHFFFAOYSA-N 287.334 3.415 70 20 CGID Cc1cc(C)c(Cn2cnc(C(C)C)cc2=O)c(C)c1 160663211 HEJOJOIEFZGEBG-UHFFFAOYSA-N 270.376 3.340 70 20 CGID CCOCCC1(C(=O)NCc2ccccc2C)CCC1 160658157 WYXDRRJURHCEFC-UHFFFAOYSA-N 275.392 3.208 70 20 CGID CC(C)C[C@H]1CCCCN1C(=O)CC1C[C@@H]2CC[C@H](C1)N2 160875890 CYPONYDZDCBESC-NPYXIHBLSA-N 292.467 3.334 70 20 CGID O=C(CCCc1cccs1)NCC1(C2CC2)CC1 159832667 SHPTXPVZEJPHKP-UHFFFAOYSA-N 263.406 3.377 70 20 CGID COc1ccc(N(C)C(=O)CCC2CCOCC2)cc1F 159454289 JXYJDFDSZCPUJS-UHFFFAOYSA-N 295.354 3.004 70 20 CGID O=C(Nc1cccc(C(F)F)c1)NC1CC=CC1 159465355 RUKLORZHYGYMCZ-UHFFFAOYSA-N 252.264 3.464 70 20 CGID C1CCC(CN2CCCN(CCOCC3CC3)CC2)CC1 159471831 AHRNPFCTWKMBMH-UHFFFAOYSA-N 294.483 3.001 70 20 CGID COc1cc(CNCc2coc3ccccc23)ccn1 159823095 VMMLZXYKQUTDFQ-UHFFFAOYSA-N 268.316 3.126 70 20 CGID CCCCOCCCNC(=O)Nc1ccc(OCC)cc1 217281508 HHEDJMFRWPTGTG-UHFFFAOYSA-N 294.395 3.414 70 20 CGID CCC(C)(CC)C(=O)Nc1cccc(S(=O)(=O)F)c1 809282742 YJWQCBFUQHICQT-UHFFFAOYSA-N 287.356 3.110 70 20 CGID CCC/C(C)=C/C(=O)Nc1cccc(S(=O)(=O)F)c1 809282754 ZCKQLMSTZWOZQU-CSKARUKUSA-N 285.340 3.030 70 20 CGID CCNCC1CCN(C(=O)[C@@H]2C[C@@H]2C2CCCCC2)CC1 161008661 LPFLHDUTRMZDLR-IAGOWNOFSA-N 292.467 3.051 70 20 CGID CC(C)N(CCSCCc1cccnc1)C(C)C 161055133 QLFYSQZZXXMLGZ-UHFFFAOYSA-N 266.454 3.476 70 20 CGID CCCn1nc(C)c(C(=O)N2CCc3ccccc3C2)c1C 161113825 NQRLJQPSAHWJBV-UHFFFAOYSA-N 297.402 3.108 70 20 CGID CC(C)Oc1ccc(CNC(C2CC2)C2CC2)cn1 160047528 BDUUVRANMFGRMP-UHFFFAOYSA-N 260.381 3.147 70 20 CGID CC1(C)CCCN(C(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)CC1 160302001 SFAAEFFJIJQRMS-HUUCEWRRSA-N 294.439 3.166 70 20 CGID CC(C)=C[C@@H]1[C@@H](C(=O)N(C)Cc2cccn2C)C1(C)C 160454680 MZAHVYGMNDFBBU-CABCVRRESA-N 274.408 3.222 70 20 CGID Cc1cc(Oc2ccc(NC(=O)c3cc[nH]c3)cc2)n[nH]1 160461088 FDUYPJFTCSBBEV-UHFFFAOYSA-N 282.303 3.091 70 20 CGID CCOc1ccc([C@@H](CC)NCC(C)(C)O)cc1OCC 160645590 KWQNHUAGEOTELJ-CQSZACIVSA-N 295.423 3.296 70 20 CGID CCCOc1ccc(-c2nc(C)c(C(=O)NC)s2)cc1 159830461 MPYHKWFUBKRKJY-UHFFFAOYSA-N 290.388 3.267 70 20 CGID CC[C@@H]1CCCCN1C(=O)[C@@H](C)Sc1ccncc1 159869916 XVZCOOPIQBQANI-CHWSQXEVSA-N 278.421 3.353 70 20 CGID COc1ccc(N(C)C(=O)c2ccccc2)cc1F 159673069 PZLDLOFFGUXMPW-UHFFFAOYSA-N 259.280 3.111 70 20 CGID CCc1noc(C)c1CNc1cccc(NC(C)=O)c1 159368126 CFBDKWIESCOMHD-UHFFFAOYSA-N 273.336 3.116 70 20 CGID Cc1cc(NC(=O)c2cc(F)cc(Cl)c2O)ccn1 160558544 ZWLIKDPOGRVAKS-UHFFFAOYSA-N 280.686 3.140 70 20 CGID CCNCC1CCN(C(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)CC1 161015646 NSORJZIBHUDLPX-CVEARBPZSA-N 292.467 3.073 70 20 CGID CCCCNC(=O)[C@@H](C)N[C@H](CC)c1ccc(F)cc1F 161027152 SNASCUAXQMKAQG-IAQYHMDHSA-N 298.377 3.310 70 20 CGID Cc1cccc(C(=O)Nc2ccc(CN(C)C)cc2)c1F 161435073 UOEQSWAZQXHSBC-UHFFFAOYSA-N 286.350 3.448 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)Cc1cccc(Br)c1 161474083 TTWXSCVLJBHKRQ-QWRGUYRKSA-N 296.208 3.391 70 20 CGID CC(C)Cc1noc(-c2csc([C@@H]3CCCO3)n2)n1 161505999 ZLRSUEFRRMYAGO-JTQLQIEISA-N 279.365 3.243 70 20 CGID CCN(C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)C1CCCCC1 160427868 LHNKRBQOHGUICH-ZBFHGGJFSA-N 294.439 3.308 70 20 CGID Cc1cc(C(=O)NC[C@H]2CCCN2CC(C)C)c(C)s1 160442553 CQFKGCNVESBXDD-CQSZACIVSA-N 294.464 3.215 70 20 CGID CC[C@@H](C)NC(=O)c1ccccc1NCc1ccco1 160459763 OOZYULYRJMXSAY-GFCCVEGCSA-N 272.348 3.420 70 20 CGID CCOCCC1(C(=O)N2C[C@H](C)C[C@@H](C)C2)CCC1 160517980 QNUYDLFWAUSFTK-ZIAGYGMSSA-N 267.413 3.088 70 20 CGID C[C@H]1C[C@@H](NCC(C)(C)O)c2cccc(Br)c21 160636351 ZBMYGMTYWVCIPS-JOYOIKCWSA-N 298.224 3.358 70 20 CGID CCCC1(CNC(=O)c2cc(C)n(C(C)(C)C)n2)CC1 160650089 QKZBQBKKCHLJRL-UHFFFAOYSA-N 277.412 3.257 70 20 CGID CSCC[C@H](C)N(C)C(=O)C[C@@H](C)c1ccncc1 160711405 GJWCAHWORXDEPI-OLZOCXBDSA-N 280.437 3.175 70 20 CGID Cn1cnnc1CN1CCC[C@H]1c1ccc(C(C)(C)C)cc1 160808106 DPDSYGLZPOUGKA-INIZCTEOSA-N 298.434 3.450 70 20 CGID CC(C)c1cc(C(=O)N2c3ccccc3OC[C@@H]2C)no1 159605069 PLAGSUMQZAIOEX-NSHDSACASA-N 286.331 3.226 70 20 CGID CCc1noc(C)c1CSCc1ncc(Cl)n1C 159827728 MWNJXCLTZKQABK-UHFFFAOYSA-N 285.800 3.366 70 20 CGID Cc1cc(NC(=O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)c[nH]c1=O 159650402 GLHXAOZVCGKUCT-YPMHNXCESA-N 290.407 3.474 70 20 CGID CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(CN)o1 159916293 FDIFNDJELQKBTL-ZDUSSCGKSA-N 278.396 3.169 70 20 CGID CCOCCCN(Cc1ccc(F)cc1F)C1CC1 159368347 XTFRQKHOBWQJET-UHFFFAOYSA-N 269.335 3.356 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(C)c(F)c1 159951228 QBRWDXWSLUEURD-UHFFFAOYSA-N 282.359 3.054 70 20 CGID c1ccn2cc(CN3CC[C@@H]4CCCC[C@@H]43)nc2c1 160562914 RAJPARREUQCOGB-ZFWWWQNUSA-N 255.365 3.099 70 20 CGID Cc1nccc(NC(=O)NC[C@H]2CCCS2)c1Cl 160022058 QINOKMINBAYSRI-SECBINFHSA-N 285.800 3.061 70 20 CGID C[C@]1(CNC(=O)NCC2(C3CC3)CCC2)CCCS1 160278913 BLLUALGPUJNPJS-CQSZACIVSA-N 282.453 3.152 70 20 CGID C[C@H](C(=O)N1CCCCCC1)c1c(F)cccc1F 160454202 VUXXAKRTVFCPJX-NSHDSACASA-N 267.319 3.471 70 20 CGID CC[C@H](C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160751805 RWAKLNCXNVQUSX-QWHCGFSZSA-N 253.386 3.031 70 20 CGID CC[C@@H](NCC1CCN(C(C)=O)CC1)c1ccc(F)cc1 160891398 YPKLQXHHWGTKTQ-QGZVFWFLSA-N 292.398 3.125 70 20 CGID CCOc1ccc(OC)cc1N[C@H](C)CCn1cccn1 159451415 SKLVPGYOVLIISF-CYBMUJFWSA-N 289.379 3.181 70 20 CGID C[C@H]1CCC[C@@H](C)N(C(=O)CCCn2cccc2)C1 159676395 SSLVRXZBYDCAJK-LSDHHAIUSA-N 262.397 3.305 70 20 CGID CC(C)Cc1ccc(CCCC(=O)N[C@@H](C)CCO)cc1 159710150 FKPYALSWJSGNKG-HNNXBMFYSA-N 291.435 3.095 70 20 CGID CCCCO[C@H]1C[C@H](N[C@@H](CC)c2cnn(C)c2)C1(C)C 159767116 HODKWEBKEJUXJY-JYJNAYRXSA-N 293.455 3.445 70 20 CGID OC[C@H]1CCCCN1Cc1csc(C2CCCC2)n1 159800154 RGRYNLCAWFMMLY-CQSZACIVSA-N 280.437 3.148 70 20 CGID CCS[C@H]1CCC[C@@H]1Nc1ncnc(CC)c1F 218056879 HTAKGPFUAMBXDF-QWRGUYRKSA-N 269.389 3.264 70 20 CGID O=C(NCc1ccc(F)cc1)Nc1cc(Cl)ccn1 217270321 BYCFPVYOWUSMNR-UHFFFAOYSA-N 279.702 3.196 70 20 CGID CCN(CCN[C@H](C)c1cscn1)C(=O)OC(C)(C)C 218240442 ISVTUSRMPJZKEI-LLVKDONJSA-N 299.440 3.051 70 20 CGID Cn1nccc1CSc1ccc2ccccc2n1 161194139 YXVYQMSEPGUFNI-UHFFFAOYSA-N 255.346 3.261 70 20 CGID CCOc1ccc(NC(=O)NC[C@H](C)SC)c(C)c1 161361321 GMBQQCWVDDAESW-NSHDSACASA-N 282.409 3.267 70 20 CGID CCCn1nccc1CNc1ccc(NC(=O)OC)cc1 160060660 GESMQDSSUXLDGO-UHFFFAOYSA-N 288.351 3.084 70 20 CGID CCCn1nccc1CN[C@@H](C)COc1ccc(C)cc1 160111331 VDNGALARADQKAV-HNNXBMFYSA-N 287.407 3.159 70 20 CGID CC[C@H](NCCOc1c(C)cccc1C)[C@H]1CCOC1 160277976 MPUCYLAILQVNBC-HOTGVXAUSA-N 277.408 3.087 70 20 CGID Cc1ccc2oc(C(=O)NCC3(CO)CCCC3)cc2c1 160313465 FEGQSNNQZJFZLL-UHFFFAOYSA-N 287.359 3.024 70 20 CGID CN(Cc1cccn1C)C(=O)c1cc2cccc(F)c2o1 160732687 PNFJITNKCYQPDU-UHFFFAOYSA-N 286.306 3.183 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CCCCCNC(C)=O 160867966 OFLHSTHJBIFCAA-HOTGVXAUSA-N 296.455 3.110 70 20 CGID Cc1nc2ccccn2c1CN(CCCO)c1ccccc1 160986582 QDYCBNGUPJCIPI-UHFFFAOYSA-N 295.386 3.032 70 20 CGID CCn1nccc1CN[C@H](c1ccc(OC)cc1)C(C)C 159907542 RVOPVWMDPDCIHC-KRWDZBQOSA-N 287.407 3.399 70 20 CGID CCC(C)(CC)C(=O)NC[C@H]1CCCN1CC(C)C 159364427 AEQVODZTDMJPCK-CQSZACIVSA-N 268.445 3.049 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1ccc(OC)cc1 159396126 PUDGQIYJGWEUCA-ZBFHGGJFSA-N 261.365 3.090 70 20 CGID CCOC(=O)[C@H]1CCCCN1Cc1cnc(C(C)C)s1 161248958 VZPWLRIAUXFKMJ-CYBMUJFWSA-N 296.436 3.184 70 20 CGID C[C@H](C(=O)Nc1cccc(S(=O)(=O)F)c1)C1CCCC1 809281771 XVVDYFPWMSKFIG-JTQLQIEISA-N 299.367 3.110 70 20 CGID CCO[C@@H](C)c1nccn1CCOc1cccc(OC)c1 161476130 RAPJOGKHGLFZRI-ZDUSSCGKSA-N 290.363 3.068 70 20 CGID C[C@H](Cc1ccc(F)cc1)NC[C@](C)(O)c1ccsc1 160014249 JHEIASYAXTUVBF-WBMJQRKESA-N 293.407 3.316 70 20 CGID CC1(C(=O)N[C@@H]2CCSc3c(F)cccc32)CC1 160161401 UUKKKOGIJIOXFL-LLVKDONJSA-N 265.353 3.279 70 20 CGID CCc1nc(CN[C@@H](C)c2ccc(OC(C)C)cc2)n[nH]1 160301347 WYSKUYXHDBORLN-LBPRGKRZSA-N 288.395 3.005 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 159804790 HRQMENLZFSXATB-YOEHRIQHSA-N 286.375 3.188 70 20 CGID CC[C@H](C)OCC(=O)Nc1cccc(-c2cnco2)c1 159636902 OUJSDZGOUZYCLG-NSHDSACASA-N 274.320 3.095 70 20 CGID CCC(C)(CC)C(=O)NC[C@H](C)c1nccs1 159482612 UHHVHRQPMBDHOC-JTQLQIEISA-N 254.399 3.189 70 20 CGID Cc1nc(CCCC(=O)NCC2(C3CC3)CC2)cs1 159784088 XXDIKMRFZMMBGV-UHFFFAOYSA-N 278.421 3.081 70 20 CGID Clc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159654616 GZMWKZTUVKDPQC-KFWWJZLASA-N 277.795 3.387 70 20 CGID CC[C@H](NC[C@H](C)N(C)Cc1ccccc1)C1CC1 160889165 JHPLEEQHNDTLCK-YOEHRIQHSA-N 260.425 3.285 70 20 CGID CNC[C@@H]1CCCN([C@@H](C)c2ccc(F)c(Cl)c2)C1 218060499 OHIQYUGQUHVWBF-RYUDHWBXSA-N 284.806 3.472 70 20 CGID CC1(C)CCCC[C@H]1CC(=O)NC[C@@H]1CCN(C2CC2)C1 160133150 XLFABQJVMFXJTB-GJZGRUSLSA-N 292.467 3.193 70 20 CGID CC1(C)CCCC[C@H]1CC(=O)NC[C@H]1CCN(C2CC2)C1 160133398 XLFABQJVMFXJTB-CABCVRRESA-N 292.467 3.193 70 20 CGID O=C(Cc1ccccc1OC(F)F)NCC1(C2CC2)CC1 160201392 OGYJAGZSTUWFKQ-UHFFFAOYSA-N 295.329 3.137 70 20 CGID Cc1cccc2ncnc(N[C@H]3CCO[C@H](C4CC4)C3)c12 160331992 JOLSJNJINRNRCE-ZFWWWQNUSA-N 283.375 3.308 70 20 CGID CCCc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1 160421902 HLWCDFBZXVHGLH-SUMWQHHRSA-N 298.434 3.205 70 20 CGID c1coc(CN(Cc2csnn2)Cc2cccs2)c1 160662180 MPXPBHYTTRLCFO-UHFFFAOYSA-N 291.401 3.395 70 20 CGID CC(C)c1cc(-c2nc(COc3ccccc3)no2)no1 160802608 IACZZSTZONRDMY-UHFFFAOYSA-N 285.303 3.427 70 20 CGID CC(C)C[C@@H](CO)NC(=O)C(C)(C)c1ccccc1Cl 160914015 DETLBDKCAICSPN-LBPRGKRZSA-N 297.826 3.141 70 20 CGID C[C@H](C(=O)NCc1nc2ccccc2[nH]1)c1ccsc1 159821484 FRMHWIAANBWXDM-JTQLQIEISA-N 285.372 3.044 70 20 CGID NC1(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)CCCCC1 159723964 MYLYGCXPLDNEJD-HZPDHXFCSA-N 286.419 3.101 70 20 CGID Cc1cccc([C@@H](C)C(=O)N[C@@H](C)CN2CCCCC2)c1 159754629 ZTKPQZHOAUBXHY-JKSUJKDBSA-N 288.435 3.089 70 20 CGID COc1cccc2cc([C@H](C)NCCc3cnn(C)c3)oc12 159756141 CMNHQKPZORHRHR-LBPRGKRZSA-N 299.374 3.068 70 20 CGID C[C@@H](NC[C@](C)(O)c1ccsc1)c1cccnc1Cl 159957818 YXWJXRMXHHIWQS-YGRLFVJLSA-N 296.823 3.355 70 20 CGID CCSc1ccc([C@H](C)NCc2nc(C)no2)cc1 159370546 LFKSPMCPNKFXCA-JTQLQIEISA-N 277.393 3.341 70 20 CGID CSCC[C@@H](C)N(C)c1nc(C(C)(C)C)ns1 159789153 XLJXJWFVUXIILY-SECBINFHSA-N 273.471 3.413 70 20 CGID CC(C)OC1CCC(NC(=O)c2cc(Cl)ccn2)CC1 159456499 NZOQDCHGSGAZNT-UHFFFAOYSA-N 296.798 3.201 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cc(F)c(F)c(F)c1 160094836 RIJRMVUQWGXSCQ-MNOVXSKESA-N 288.357 3.485 70 20 CGID CCCn1nccc1CNCC(C)(C)c1cccs1 160180033 CUVGIORQPRGHIQ-UHFFFAOYSA-N 277.437 3.422 70 20 CGID C[C@@H]1CCC[C@H](CNC(=O)N2CCCCCC2)C1 218050657 ALHUGOBTAWBXRN-KGLIPLIRSA-N 252.402 3.398 70 20 CGID Cc1n[nH]cc1CN1CCC(c2nc3ccccc3o2)CC1 161070598 RCVDVLJPBOREGR-UHFFFAOYSA-N 296.374 3.239 70 20 CGID CC[C@@H](C)Oc1ccc(C(=O)N[C@H](CO)CC(C)C)cc1 161231706 VGPBAJJJSKCBED-HIFRSBDPSA-N 293.407 3.001 70 20 CGID C[C@@H]1CC(NC(=O)NCC(C)(C)C2CCCC2)C[C@@H](C)O1 160224325 WIAXBETXPGKLSF-CHWSQXEVSA-N 296.455 3.458 70 20 CGID COc1ccc([C@H](NC(=O)[C@@H]2CCCCO2)C(C)C)cc1 160230694 JBQJEZVMYAJXKU-JKSUJKDBSA-N 291.391 3.078 70 20 CGID CCCN(CC(=O)OC(C)(C)C)[C@H](C)c1ccccn1 160327800 REZHPULHJMKCTG-CYBMUJFWSA-N 278.396 3.196 70 20 CGID Fc1ccc2oc(N[C@@H]3CCO[C@@H](C4CC4)C3)nc2c1 160352308 GSOIJZOVECRSMN-BXUZGUMPSA-N 276.311 3.336 70 20 CGID CC1(NC(=O)NC2CC(c3ccccc3)C2)CCC1 160693328 UIARKIXCEBVAAY-UHFFFAOYSA-N 258.365 3.174 70 20 CGID CCCN(CC1CC1)C(=O)c1ccc(C(C)C)nc1 160679995 IOJCIUPOFNSVRF-UHFFFAOYSA-N 260.381 3.467 70 20 CGID COCCc1nsc(N[C@H]2CCCCC2(C)C)n1 160689268 SHLYHCFEZVGABD-JTQLQIEISA-N 269.414 3.108 70 20 CGID CCCSCC(=O)N[C@@H](CC)c1c(C)noc1C 160752611 VUWLXFJQMAPTAS-NSHDSACASA-N 270.398 3.002 70 20 CGID C[C@@H]1CCN(C(=O)NC[C@@H]2Cc3ccccc32)C[C@@H]1C 160825261 GBUFUEWWTUUFJM-IPYPFGDCSA-N 272.392 3.014 70 20 CGID CCSc1cccc(-c2nc([C@@H]3CCOC3)no2)c1 160888010 KHHQSTVMYAGHDO-LLVKDONJSA-N 276.361 3.353 70 20 CGID Cc1ccc(C(=O)NCC2(N)CCCCC2)cc1Cl 159605195 KMEMWJSCOAPSAG-UHFFFAOYSA-N 280.799 3.040 70 20 CGID C[C@@H](CNCc1cc(F)cc(Cl)c1)N1CCCCC1 160905911 QUQAMYJOOLOJQA-LBPRGKRZSA-N 284.806 3.443 70 20 CGID Cc1ccccc1NC(=O)NC[C@@H](C)c1nccs1 160373790 QFFVLRPQZQKDCR-LLVKDONJSA-N 275.377 3.377 70 20 CGID C[C@@H]1CCC[C@H]1CC(=O)Nc1ccc(S(=O)(=O)F)cc1 864237655 BUFCLGUDPMGSPL-MNOVXSKESA-N 299.367 3.110 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CCC(=O)N(CC)CC 161209254 VNYHDWMSQZAWFL-CABCVRRESA-N 296.455 3.062 70 20 CGID Cc1ccc(NC(=O)N(C)[C@@H]2CCC[C@@H](C)C2)cn1 161504665 CTUKEIUWYGRTDX-BXUZGUMPSA-N 261.369 3.432 70 20 CGID C[C@H](C(=O)N[C@@H]1CCOC2(CCCC2)C1)c1ccsc1 160256359 NWKTZVPHGQZAJO-GXTWGEPZSA-N 293.432 3.460 70 20 CGID Cc1cc(N(C)C)ccc1NC(=O)N[C@@H](C)C1CCC1 160820807 OVZRAFXEDBXYOI-LBPRGKRZSA-N 275.396 3.371 70 20 CGID CCOCCCN1CCCN(CC2CCCCC2)CC1 159472769 NZPNBSKKBXAZIX-UHFFFAOYSA-N 282.472 3.001 70 20 CGID COc1ccc(N(C)C(=O)c2cc(Cl)ccn2)cc1F 159670958 YMMGRRWBWFTYLC-UHFFFAOYSA-N 294.713 3.159 70 20 CGID CCC(CC)C(=O)N[C@H]1CCOC2(CCCC2)C1 159923459 NPXTWWIKFNQMFW-ZDUSSCGKSA-N 253.386 3.031 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(F)cc1F 159777446 VEOPPGOPMIQSLE-ZANVPECISA-N 253.292 3.273 70 20 CGID Cc1cccc(CCNC(=O)Nc2nc(C)c(C)s2)c1 217409710 IRBJLWJRIQNCMR-UHFFFAOYSA-N 289.404 3.433 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCN3CCCC[C@@H]23)c(F)c1 218124997 QUQUPNJLLZSQBG-VUCTXSBTSA-N 292.398 3.112 70 20 CGID C[C@@H](NCC(C)(C)O)c1cc(Cl)sc1Cl 160614695 KLKNERVOQUIMQT-ZCFIWIBFSA-N 268.209 3.476 70 20 CGID Cc1ccc(C)c(Cn2cnc(C(C)C)cc2=O)c1 160895661 YDJFGQGVSDQBFA-UHFFFAOYSA-N 256.349 3.032 70 20 CGID O=S(=O)(Cl)CCCCSc1ccc(F)cc1 100495491 WYVQUDHIPLMQHL-UHFFFAOYSA-N 282.789 3.267 70 20 CGID CCCCNC(=O)[C@H](C)N[C@@H](CC)c1ccc(F)cc1F 161027028 SNASCUAXQMKAQG-NHYWBVRUSA-N 298.377 3.310 70 20 CGID CC(C)C[C@H](CO)NC(=O)C[C@H](c1ccccc1)C(C)C 161203075 NRPPFQMHGSWWCM-SJORKVTESA-N 291.435 3.340 70 20 CGID COCC(C)(C)c1nc(Cc2cccc3cccnc23)no1 161426094 UMEBCWLHXAKTPS-UHFFFAOYSA-N 297.358 3.133 70 20 CGID C[C@H](Sc1nnc(-c2ccco2)n1C)C(F)(F)F 161495965 SUSWFUAJFPSFIU-LURJTMIESA-N 277.271 3.118 70 20 CGID O=C(NCC(F)(F)F)N[C@@H]1CCCc2cc(F)ccc21 160046584 IHIFAJNVJIEREV-LLVKDONJSA-N 290.260 3.065 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1cnc(C)cn1 160129367 RBAXNUXBTZRNNM-LBPRGKRZSA-N 286.331 3.020 70 20 CGID CC[C@@H](C)NC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 160183523 KEUYOCIZPICODZ-WZRBSPASSA-N 282.409 3.018 70 20 CGID CN(Cc1cccn1C)C(=O)CCc1cccc(Cl)c1 160612721 XAELTIDUBCFMCO-UHFFFAOYSA-N 290.794 3.270 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)Nc1cc(C(=O)OC)cs1 160629804 VBXKTWFQXDVQJE-MWLCHTKSSA-N 296.392 3.235 70 20 CGID C[C@@H]1C[C@@H](NCC(C)(C)O)c2cccc(Br)c21 160636220 ZBMYGMTYWVCIPS-BXKDBHETSA-N 298.224 3.358 70 20 CGID Cc1cccc(F)c1NS(=O)(=O)Cc1ccccc1 160815401 KPLAOGNFQMGURC-UHFFFAOYSA-N 279.336 3.076 70 20 CGID Cc1cccc(NC(=O)COC/C=C/c2ccccc2)c1O 159878258 QNTXFANNOYHXSY-UXBLZVDNSA-N 297.354 3.369 70 20 CGID CN(CCC(=O)OC(C)(C)C)c1nc(C(C)(C)C)ns1 159956754 BKSHBIUBTFOJCS-UHFFFAOYSA-N 299.440 3.004 70 20 CGID CCCCSCCC(=O)N(Cc1cccnc1)C1CC1 159375340 LGTHKIRZPKNGAA-UHFFFAOYSA-N 292.448 3.496 70 20 CGID COCCN(Cc1ccccc1)Cc1occc1C 160449018 DYDYRMZIESGKAS-UHFFFAOYSA-N 259.349 3.237 70 20 CGID Cc1nc2ccccc2nc1N[C@@H]1CCOC(C)(C)C1 160676087 XKPZUYDYFNMDPD-GFCCVEGCSA-N 271.364 3.308 70 20 CGID CC(C)N1CC[C@H](CNCc2ccc(Cl)cc2F)C1 160789237 HMPWKSGEPQQEEE-GFCCVEGCSA-N 284.806 3.299 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc(F)c(F)c(F)c1 160048240 LRDBIAPYPVJQTE-UHFFFAOYSA-N 269.266 3.024 70 20 CGID COc1cc(Br)c(F)cc1OC(C)C 218498154 GOSGIZRCNNVDIX-UHFFFAOYSA-N 263.106 3.384 70 20 CGID O=C(NC1CC=CC1)c1cc(-c2ccc(Cl)cc2)on1 161079397 SOXQWAFCBZIEFT-UHFFFAOYSA-N 288.734 3.443 70 20 CGID Cc1cccc(N(C)C(=O)c2cncc(OC(C)C)c2)c1 161241018 BERJADBWBOJQSV-UHFFFAOYSA-N 284.359 3.454 70 20 CGID CCn1cc([C@H](C)NCC2(c3ccc(F)cc3)CC2)cn1 161349122 RODXTBXZKCQAEN-ZDUSSCGKSA-N 287.382 3.425 70 20 CGID CC(C)C[C@@H](C)NC(=O)c1csc([C@H]2CCCO2)n1 161353501 ZILDEYNVVHXQLN-ZYHUDNBSSA-N 282.409 3.159 70 20 CGID Cc1ccc(CCNC(=O)C[C@H](C)c2c(C)n[nH]c2C)cc1 160210895 HURAWIVRHXFUAH-ZDUSSCGKSA-N 299.418 3.187 70 20 CGID Cn1ccc(-c2nc3ccc(Br)cc3[nH]2)c1 160272350 YSRKVJKOCJHQLJ-UHFFFAOYSA-N 276.137 3.331 70 20 CGID O=C(NCC1(c2ccccc2)CCCC1)[C@H]1CCCCO1 160387538 HRYUWSLNQHEAIC-MRXNPFEDSA-N 287.403 3.184 70 20 CGID CN(Cc1cccc(F)c1)Cc1c[nH]nc1C(C)(C)C 160466586 YXBMUBIXTHULPS-UHFFFAOYSA-N 275.371 3.478 70 20 CGID C[C@H](CC(=O)N(C)c1ccc(Cl)cn1)c1ccncc1 160502248 NMPCUUCGLIIFMX-LLVKDONJSA-N 289.766 3.287 70 20 CGID CCCc1csc(CN(C)C(=O)c2ccccc2)n1 160649277 MBNNRDWBZCFONN-UHFFFAOYSA-N 274.389 3.368 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1 160941001 LEVUARJDCZGCBZ-LLVKDONJSA-N 280.343 3.213 70 20 CGID Cc1ccc(O)c(C(=O)N2CCC(OC(C)(C)C)CC2)c1 160957327 ZQPRIODEZLVREU-UHFFFAOYSA-N 291.391 3.120 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccncc1 159923115 KMZHDLIFUYNLGV-NEPJUHHUSA-N 258.346 3.194 70 20 CGID C[C@H](CCn1cccn1)Nc1ccccc1OC(F)F 159392471 QZMKJBPUTYDWOO-LLVKDONJSA-N 281.306 3.375 70 20 CGID CCC1(CNC(=O)N(C)CC2CCOCC2)CCCC1 159997897 DZZCVUAMBLJKRY-UHFFFAOYSA-N 282.428 3.025 70 20 CGID CCO[C@@H]1C[C@@H](N[C@@H]2CCOC(C)(C)C2)C12CCCC2 159940503 LFBGMZPEGIZZOB-RBSFLKMASA-N 281.440 3.271 70 20 CGID COc1cc(NC(=O)c2ccc(C)cc2O)ccc1F 160408554 ZJMOWEJMNTXUTD-UHFFFAOYSA-N 275.279 3.101 70 20 CGID CCCCN(C(=O)CCl)C1CC(C)(C)NC(C)(C)C1 59445873 XDYTUISPVQFVQN-UHFFFAOYSA-N 288.863 3.163 70 20 CGID COc1ccc(O)c(NC(=O)c2ccc(Cl)c(F)c2)c1 159384439 SIJNUAGHSIRJIG-UHFFFAOYSA-N 295.697 3.446 70 20 CGID C[C@@H]1CCC[C@H](NC(=O)c2ccnc(Cl)c2F)C1 161412597 DGMUWDMKRPYYHD-BDAKNGLRSA-N 270.735 3.183 70 20 CGID CC[C@@H]1CCCN1C[C@@H](O)c1cc2ccccc2o1 216866504 CQUVIVNCTKEODA-ZIAGYGMSSA-N 259.349 3.341 70 20 CGID CC(C)n1nccc1C(=O)N[C@@H]1C[C@H]1C1CCCCC1 160098974 YVOPKFANUKIUPE-UONOGXRCSA-N 275.396 3.163 70 20 CGID CC(C)(C(=O)N1CCCSCC1)C1CCCC1 159844842 BJYZHNNPKSKALH-UHFFFAOYSA-N 255.427 3.168 70 20 CGID CC[C@@H]1CN(C(=O)Nc2ccnc(C)c2Cl)C[C@H](C)O1 159902489 VYMIOFCHMHCWHP-GXSJLCMTSA-N 297.786 3.075 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@@H]1CCC[C@@H](C)C1 159925807 HQBLAKICAUEHJX-UKRRQHHQSA-N 289.423 3.058 70 20 CGID C[C@@H](CC(=O)N[C@H](C)CCC(C)(C)C)C1CCNCC1 159773314 IHVMRMSWJUHKTF-UONOGXRCSA-N 282.472 3.343 70 20 CGID Oc1ccc(CCNCc2coc3ccccc23)cc1 161096096 CNUCTDMSCPIWEI-UHFFFAOYSA-N 267.328 3.471 70 20 CGID Cc1ccc(NC(=O)NCCC2CCCCC2)nc1 217305279 IFZXVZITCBZMJG-UHFFFAOYSA-N 261.369 3.482 70 20 CGID CCCC1CCC(NC(=O)CO[C@@H](C)CC)CC1 160765283 WMKYXOYULNZNSY-HSBZDZAISA-N 255.402 3.277 70 20 CGID C[C@H](c1ccc(OC(F)F)cc1)N1CCC[C@@H](CN)C1 217527142 GLCPLRIIBRRZSK-NEPJUHHUSA-N 284.350 3.020 70 20 CGID CCc1nnsc1C(=O)N(C)[C@H]1CCCC[C@@H]1CC 161040939 WQNBSKFGXXPAHT-JQWIXIFHSA-N 281.425 3.141 70 20 CGID CC(C)C[C@@H](CO)NC(=O)c1ccc(SC(C)C)cc1 161250326 JKMMGUHOKBJWOM-AWEZNQCLSA-N 295.448 3.324 70 20 CGID CCc1ncc(NC(=O)[C@@H](CC)c2ccc(F)cc2)cn1 161311259 LCBMTIWOHHDALA-AWEZNQCLSA-N 287.338 3.310 70 20 CGID CC(C)CCNC(=O)[C@@H](C)c1c(F)cccc1F 161388073 CTKVLAPHFDZIEI-JTQLQIEISA-N 255.308 3.231 70 20 CGID CC[C@H](C)N(C)CCNC1CCN(C2CCCCC2)CC1 160061615 IJSOHMBXLALANF-INIZCTEOSA-N 295.515 3.103 70 20 CGID CC/C=C(/C)C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 160166843 WGESNTOYUYHLOJ-FVCQUJQRSA-N 275.392 3.014 70 20 CGID COc1cc(C)ccc1CNC(=O)N[C@H](C)CC(C)C 160259793 SZXXOARUYPEXKK-CYBMUJFWSA-N 278.396 3.237 70 20 CGID CC[C@H](C)Oc1ccc(C(=O)NCC(N)(CC)CC)cc1 160519851 GLWYJWKTBKAZBB-ZDUSSCGKSA-N 292.423 3.111 70 20 CGID CC1(C)C[C@@H](NCc2ccc(OCC(F)F)cc2)CCO1 160546077 SZPNNLIVNCVQSQ-ZDUSSCGKSA-N 299.361 3.378 70 20 CGID CC(C)c1nsc(N[C@H]2CCOC(C)(C)C2)n1 160687182 PVZZYPHAJAOLFO-VIFPVBQESA-N 255.387 3.031 70 20 CGID O=C(C[C@@H]1C=CCC1)N1CCc2c(F)cccc2C1 160785255 KXCJOMVFOYCZJM-GFCCVEGCSA-N 259.324 3.067 70 20 CGID C[C@H](c1nc(C2CCOCC2)no1)c1c(F)cccc1F 160868909 QPIJMWBBBNRWNR-VIFPVBQESA-N 294.301 3.394 70 20 CGID Cc1cc([C@H](C)NC(=O)c2ccc(O)nc2C)c(C)s1 159629068 OXGJMPLYBWEUJL-JTQLQIEISA-N 290.388 3.265 70 20 CGID CN1CCC(CCNC(=O)C2CCC(C)(C)CC2)CC1 159695217 KWUSLJRERXKHGL-UHFFFAOYSA-N 280.456 3.051 70 20 CGID CC(C)N(CCc1nccs1)C(=O)N[C@H]1C=CCCC1 159793133 RYTFASUQHXTBGG-ZDUSSCGKSA-N 293.436 3.214 70 20 CGID C1CCN(CCCN2CC[C@@H]3CCCC[C@@H]32)CC1 160768897 KXRLQCSTGDAFCO-HOTGVXAUSA-N 250.430 3.127 70 20 CGID CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)c1ccc(CN)cc1 217822544 MLYHGVAPQYBZBT-XYPHTWIQSA-N 288.435 3.336 70 20 CGID Cc1cccc([C@H]2CCCN2CCc2ccccn2)n1 159752223 RDRUIIGUJSAPPH-QGZVFWFLSA-N 267.376 3.165 70 20 CGID C[C@@]1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CC=CCC1 864237882 BGNRGFINVRVLFR-CQSZACIVSA-N 297.351 3.030 70 20 CGID C[C@H](CNCc1cccc2cc[nH]c12)N1CCCCC1 218123503 ARWBGQRPEOQTLC-CQSZACIVSA-N 271.408 3.132 70 20 CGID O=C(NC1CC=CC1)c1cnn(-c2ccccc2)c1C1CC1 161022490 OTOUVXMVNPVZLE-UHFFFAOYSA-N 293.370 3.198 70 20 CGID O=C(NC1CC=CC1)c1ccccc1C(F)(F)F 161073074 LIWJPYAABAMNAU-UHFFFAOYSA-N 255.239 3.154 70 20 CGID CCc1ncc(NC(=O)N(C)[C@@H]2CCCC[C@H]2CC)cn1 161137726 LEHXOTDEWACCNI-TZMCWYRMSA-N 290.411 3.472 70 20 CGID CCCn1nc(C)c(C(=O)NC2CCCCCC2)c1C 161236603 XFRUUNKATWQTHI-UHFFFAOYSA-N 277.412 3.363 70 20 CGID CC[C@H]1CCCC[C@@H]1NCC(=O)N(C)Cc1ccccc1 161412978 DRJMBMAGCKWTIR-IRXDYDNUSA-N 288.435 3.203 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@H]1CCCC[C@H]1C 160006827 JYTZIBQJUIKVRS-CZUORRHYSA-N 289.423 3.058 70 20 CGID CC(C)N(CC(F)(F)F)C(=O)C[C@@H](C)c1ccncc1 160047747 IDSNEQCFPLFJKD-LLVKDONJSA-N 288.313 3.375 70 20 CGID COc1ccc(F)cc1[C@@H](C)NC(=O)C[C@@H](C)SC 160083523 PGOPFCQPWJJYHD-NXEZZACHSA-N 285.384 3.153 70 20 CGID Cc1nc(CNC(=O)C(C)(C)C2CCCC2)cs1 160223793 UWLXSIYVLDAODN-UHFFFAOYSA-N 266.410 3.284 70 20 CGID CCCCOCC(=O)O[C@H](c1ccccn1)C(F)(F)F 160319869 MGIJMLUATLYTPK-GFCCVEGCSA-N 291.269 3.045 70 20 CGID CC[C@H](Cc1ccccc1)NC(=O)NC1(C)CCC1 160651359 CKRAATQKFFMNDG-CQSZACIVSA-N 260.381 3.250 70 20 CGID CN(Cc1cccn1C)C(=O)c1cc2ccccc2cc1O 160741816 QBNOSLULFMCHPM-UHFFFAOYSA-N 294.354 3.156 70 20 CGID CNc1ccccc1C(=O)N1CC[C@H](C(C)(C)C)C1 160953392 IPYSQAUKWNMUFK-LBPRGKRZSA-N 260.381 3.237 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCc1nc2ccccc2s1 159678643 OOBPTTPRNIFGKX-BONVTDFDSA-N 274.389 3.349 70 20 CGID CCCCn1ncc(NC(=O)NC(CC)CC)c1C 159713072 CDJOTFCOKYGTIJ-UHFFFAOYSA-N 266.389 3.302 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(F)c(F)c1)[C@H]1CCCO1 159385786 HHEPKRUEJBLLGP-CHWSQXEVSA-N 284.306 3.044 70 20 CGID C[C@@H](CC(=O)N[C@H](C)CNc1ccccc1)c1ccncc1 159584382 FTIVZWIDSZFJAJ-LSDHHAIUSA-N 297.402 3.192 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(Cl)ccn1 159578633 GNPWZHJBNOSOMV-GXSJLCMTSA-N 252.745 3.044 70 20 CGID COc1cc(CN[C@@H](C)c2ccsc2)cc2c1OCO2 159900809 JEVDFJNVBWSXNB-JTQLQIEISA-N 291.372 3.336 70 20 CGID Nc1cc(C(F)(F)F)ccc1C(=O)OCCC1CC1 217707375 HKQKYENURGQEOO-UHFFFAOYSA-N 273.254 3.245 70 20 CGID O=C(OCCOc1ccccc1)c1cc(F)cnc1Cl 218160675 QISWCAPGLCNKEV-UHFFFAOYSA-N 295.697 3.110 70 20 CGID CC[C@H](C(=O)Nc1ccc2[nH]nnc2c1)c1ccc(F)cc1 161102780 LRDHMHXBAQMECM-ZDUSSCGKSA-N 298.321 3.229 70 20 CGID CCC1(CO)CCN(CCC(=O)c2ccc(C)cc2)CC1 161304961 FMZMYSZEHKKLDM-UHFFFAOYSA-N 289.419 3.052 70 20 CGID Cc1cc(C)c(C(=O)N[C@H](C)CC(=O)c2cccs2)o1 160698941 LILOZWWZTOVPMC-SNVBAGLBSA-N 291.372 3.349 70 20 CGID CSc1cc(C(=O)N[C@H](C)C[C@@H]2CCCO2)ccc1F 160837499 IUBRBOZNPWHXSB-PWSUYJOCSA-N 297.395 3.235 70 20 CGID CC(C)(C)CCC(=O)NCCCNc1ccccc1 159608579 YMECEDYPWSULQP-UHFFFAOYSA-N 262.397 3.431 70 20 CGID Cc1cccc(C(=O)NCC2(O)CCCCCC2)c1Cl 160382167 LYQLBHKNYBYFIK-UHFFFAOYSA-N 295.810 3.464 70 20 CGID Cc1cccc(C(=O)NCC2(O)CCC(C)CC2)c1Cl 160381252 DWASYVSIVGXCRC-UHFFFAOYSA-N 295.810 3.319 70 20 CGID CN(CCNC(=O)NC1CCCCCC1)c1ccccc1 217654852 LWWCWBSMOANJOE-UHFFFAOYSA-N 289.423 3.145 70 20 CGID CCN1CCC[C@@H]1CN[C@H](c1ccccc1)C(C)C 217876150 HRRWYGIRLRYLBF-SJORKVTESA-N 260.425 3.458 70 20 CGID CN(C)[C@@H]1CCC[C@H](N[C@@H]2CCCOc3ccccc32)C1 161091624 LEKPSWFVYIVIEN-ZMSDIMECSA-N 288.435 3.363 70 20 CGID CCN(CC)C(=O)c1cnc2c(C)cc(C)cc2c1O 161180760 MHEPCCHFSARRCK-UHFFFAOYSA-N 272.348 3.039 70 20 CGID CCNC(=O)CN(Cc1ccccc1)c1cccc(C)c1 161268172 UBCWJKJRUJAIEB-UHFFFAOYSA-N 282.387 3.138 70 20 CGID CCc1cc(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)sc1C 161325710 ZLNFNRHAWXLOSH-VIFPVBQESA-N 291.420 3.011 70 20 CGID CCCSCC(=O)N[C@@H]1CCCc2sccc21 160113432 POCOGVSYINJERN-LLVKDONJSA-N 269.435 3.385 70 20 CGID COc1ccc(CN2CC[C@@H]3CC[C@H](C2)N3C)cc1Cl 160119438 GJADGBFVSLVONQ-UONOGXRCSA-N 294.826 3.017 70 20 CGID COCCC1(C(=O)N[C@@H]2CCCc3sccc32)CCC1 160157145 ILADVLZBUZMYRN-CYBMUJFWSA-N 293.432 3.449 70 20 CGID CC(C)[C@H]1CCCC[C@@H]1Nc1ccc(OCC(N)=O)cc1 160306735 FYJSPEOLCRUCDN-CVEARBPZSA-N 290.407 3.177 70 20 CGID C[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1cnc2ccccn12 160478002 MGYAVPUBIZKCCE-YCPHGPKFSA-N 269.392 3.487 70 20 CGID CCCCN(CC)C(=O)c1cnn(CCCC)c1C 160610559 CSQKPCRCPRDBBH-UHFFFAOYSA-N 265.401 3.254 70 20 CGID CCCn1nc(C)c(C(=O)NCC2(CCC)CC2)c1C 160752366 PKPABMYLNKADRR-UHFFFAOYSA-N 277.412 3.220 70 20 CGID CCSCC[C@H](C)NC(=O)C[C@@H](C)c1ccncc1 160926943 KZSNYZHLXSZZCS-OLZOCXBDSA-N 280.437 3.223 70 20 CGID Cc1ccc(-c2nnc([C@H](C)Nc3cc(C)n(C)n3)o2)cc1 159624589 RBEGMLDWPLXSGR-LBPRGKRZSA-N 297.362 3.260 70 20 CGID CCC[C@@H]1[C@H](C)CCCN1C(=O)NCCc1cscn1 159478590 YSPVAXDOIKSKFE-TZMCWYRMSA-N 295.452 3.296 70 20 CGID CC[C@H](NCCc1cc(C)cc(C)c1)[C@H]1CCOC1 159499012 HXAFESIJJNBSKZ-IRXDYDNUSA-N 261.409 3.251 70 20 CGID C[C@@H](CCc1ccco1)NC[C@@](C)(O)c1ccsc1 159976797 RNXVBQCPRHBCIN-SWLSCSKDSA-N 279.405 3.160 70 20 CGID CCC(CC)NC(=O)NCCc1ccc(Cl)cc1 217305032 PAWNMWVDZBWFQH-UHFFFAOYSA-N 268.788 3.370 70 20 CGID CS[C@@H]1CC[C@@H](Nc2ncnc3c2CCCC3)C1 217808852 HNMWBSWXHWCINW-GHMZBOCLSA-N 263.410 3.051 70 20 CGID COc1ccc(Cl)c(NC(=O)C[C@H](C)SC)c1 161185034 XVXFYOSOGWCBMV-QMMMGPOBSA-N 273.785 3.429 70 20 CGID Cc1ccc(NC(=O)N(C)[C@H]2CCC[C@H](C)C2)cn1 161504550 CTUKEIUWYGRTDX-FZMZJTMJSA-N 261.369 3.432 70 20 CGID O=C(Cc1ccc(OC(F)F)cc1)NCC1(C2CC2)CC1 160151912 FLGKXYMXPGEICE-UHFFFAOYSA-N 295.329 3.137 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)Nc1cc(C(=O)OC)cs1 160629682 VBXKTWFQXDVQJE-ONGXEEELSA-N 296.392 3.235 70 20 CGID CC(C)(O)CN[C@@H]1CCC[C@H]1CCc1ccccc1 160652541 CIKQNZHMZQZUCZ-JKSUJKDBSA-N 261.409 3.148 70 20 CGID O=C(CCC1CC1)NCCc1cc2ccccc2[nH]1 159624494 UDZYIWGVOUOLDA-UHFFFAOYSA-N 256.349 3.017 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1ccc(OC)cc1F 160066805 ZOKMGTOWKQLAEN-STQMWFEESA-N 282.403 3.215 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1F 160999025 KGSYORZOLLUYOG-MCIONIFRSA-N 264.388 3.349 70 20 CGID CC[C@H](C)N(C)CCNCc1cccc2c1OC(C)(C)C2 217798306 FJBADPWZWCCXBK-AWEZNQCLSA-N 290.451 3.220 70 20 CGID Cc1cccc([C@H](C)C(=O)N(C)Cc2cccn2C)c1 161004441 KZGWGWIFVQMTBU-AWEZNQCLSA-N 270.376 3.096 70 20 CGID CCc1nc(C)c([C@H](C)NCCN(C)[C@@H](C)CC)s1 160063760 BEJHYBTZCUTQLF-RYUDHWBXSA-N 283.485 3.395 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1cc(C)oc1C 160153399 LGYFTSUOPOYWHP-OAHLLOKOSA-N 285.343 3.322 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@@H]1C[C@@H]2CC[C@@H]1O2 160196580 BBXRYIZEZFNEPL-GMZLATJGSA-N 290.359 3.175 70 20 CGID CNC(=O)c1ccc(NC(=O)c2cccs2)c(Cl)c1 160267005 DBBFKYZPRIWVTQ-UHFFFAOYSA-N 294.763 3.013 70 20 CGID Cc1ccc(F)cc1C(=O)N(C)c1ccc2c(c1)OCO2 160431400 USJLHGUYVNIYGX-UHFFFAOYSA-N 287.290 3.139 70 20 CGID C[C@H](CC(=O)N1CCC[C@@H]1C1CCC1)c1ccncc1 159950512 RDZKMEBGPYSYOG-CZUORRHYSA-N 272.392 3.366 70 20 CGID CCCN(C)[C@H]1CCCN(c2ccccc2Cl)C1=O 159779755 IXFWBZKLZUWEGR-AWEZNQCLSA-N 280.799 3.177 70 20 CGID Cc1cc(Cl)ccc1OC(=O)[C@@H]1CCCCO1 159584968 BITAPLFACPPLSH-LBPRGKRZSA-N 254.713 3.123 70 20 CGID CC(C)C[C@@H](CNCc1cc(F)cc(F)c1)N(C)C 159890061 MMCKEAOYPKBMMH-HNNXBMFYSA-N 270.367 3.031 70 20 CGID CC(C)[C@H](CCO)NC(=O)c1ccc(C(C)(C)C)cc1 160708142 WWEZLROSJVOYIY-HNNXBMFYSA-N 277.408 3.121 70 20 CGID CC(C)N(CCSCc1cccnc1)C(C)C 161010650 BYLANURGELKNTC-UHFFFAOYSA-N 252.427 3.434 70 20 CGID Cc1ccccc1[C@@H](CC(C)C)NCC(=O)NC(C)C 161007807 OVBJZJATCYOURQ-MRXNPFEDSA-N 276.424 3.196 70 20 CGID CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCCO1 161051910 SONOYZQTTYGFPC-MCIONIFRSA-N 267.413 3.277 70 20 CGID Cc1ccccc1[C@H](C)NC(=O)N[C@@H](CCO)C(C)(C)C 161102933 WUBUDBVWNWKUPC-ZFWWWQNUSA-N 292.423 3.152 70 20 CGID COC[C@@H](NC(=O)[C@H](C)Cc1ccc(Cl)cc1)C1CC1 161284197 XWEJRCWVSGOWKM-IAQYHMDHSA-N 295.810 3.060 70 20 CGID CCO[C@@H]1C[C@H](N[C@@H](C)C2CCN(C)CC2)C1(CC)CC 161318037 WSEBVHXSAKEYBW-BHYGNILZSA-N 296.499 3.290 70 20 CGID CCOc1ccc(NC(=O)N(C)[C@H]2CCSC2)c(C)c1 161429735 ADFIPIFGALCDJC-LBPRGKRZSA-N 294.420 3.363 70 20 CGID CC[C@@H]1CCCC[C@H]1NC(=O)c1ccc(CN(C)C)cc1 160101280 OKRMOKXCFNFMPZ-NVXWUHKLSA-N 288.435 3.447 70 20 CGID Cc1ccc(CC(=O)N[C@H]2CCCc3sccc32)cn1 160222159 HTDYUOGESZEGHN-AWEZNQCLSA-N 286.400 3.188 70 20 CGID CS[C@H](C)CNC(=O)N[C@@H]1CCCCC1(C)C 160265948 WHQIYHBMJHOBFC-GHMZBOCLSA-N 258.431 3.006 70 20 CGID CSC[C@@H]1CCCN1C(=O)C[C@H](C)c1c(C)noc1C 160530798 SVAJIANZWJISGK-GWCFXTLKSA-N 296.436 3.139 70 20 CGID Cc1ccccc1C1(CNC(=O)NC2(C)CCC2)CC1 160543367 CBTJCNDRMNFLEN-UHFFFAOYSA-N 272.392 3.268 70 20 CGID CC[C@H](CNC(=O)C1=C(C)OCCC1)c1ccccc1 160703747 IKZNPPLUGRGLQM-CQSZACIVSA-N 273.376 3.381 70 20 CGID CCC(=O)c1cccc(NC(=O)C2[C@H]3CCC[C@@H]23)c1 160734935 VMOGYYDRLQKCOJ-NNQSOWQGSA-N 257.333 3.264 70 20 CGID O=C(CCc1cscn1)N[C@@H]1CCCc2sccc21 159810602 YKJADMXTELSYPW-GFCCVEGCSA-N 292.429 3.331 70 20 CGID COc1cc(C(=O)N2CCC[C@H](C)c3ccccc32)on1 159817794 MQCSZPLTAPKYPM-NSHDSACASA-N 286.331 3.227 70 20 CGID CCCCS(=O)(=O)N[C@@H](CC)c1ccc(F)cc1F 159632433 QVNZZIJCINSVNX-ZDUSSCGKSA-N 291.363 3.135 70 20 CGID CCOc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159475494 SOWKZUNPBFZLQG-ULQDDVLXSA-N 287.403 3.133 70 20 CGID CC[C@H]1CCCCN1C(=O)[C@@H](C)Sc1ccncc1 159870036 XVZCOOPIQBQANI-OLZOCXBDSA-N 278.421 3.353 70 20 CGID CCC[C@H](N[C@H](C)c1cccc(F)c1F)C(=O)OCC 159485969 VXOIPEXMPOZAPB-MFKMUULPSA-N 285.334 3.347 70 20 CGID Cc1cnc(COC(=O)[C@@H]2C[C@H]2c2sccc2C)cn1 159394028 UDFQOELEVLSJCM-CHWSQXEVSA-N 288.372 3.002 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1ccnc(Cl)c1 159823462 KXSBRGNUZUZZHW-KOLCDFICSA-N 252.745 3.044 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(F)c(Cl)c1 159867558 BLJYFZIHXUTZEQ-UHFFFAOYSA-N 267.731 3.399 70 20 CGID CC(C)Sc1ccccc1NC(=O)c1cn[nH]c1 160887842 YWHNHSVLRXSSQY-UHFFFAOYSA-N 261.350 3.163 70 20 CGID CC[C@H](C)N(C)CCNCc1csc(C(C)(C)C)n1 217394269 XQTGQFFQNWJHOD-LBPRGKRZSA-N 283.485 3.261 70 20 CGID CC[C@H](C(=O)N[C@H]1CCOC(C)(C)C1)c1ccc(F)cc1 161375159 CQTNVBGHSFOCIO-GJZGRUSLSA-N 293.382 3.393 70 20 CGID C[C@H](CNC(=O)C(C)(C)C1CCCC1)CN1CCCC1 160317699 ULXIWACNVGKGMP-CQSZACIVSA-N 280.456 3.051 70 20 CGID COc1ccc(C)cc1NC(=O)N[C@H](C)C1CCC1 159413354 ZVVIXBOUGJCIAX-LLVKDONJSA-N 262.353 3.314 70 20 CGID Cc1c(NC(=O)N[C@H](C)C2CC2)cnn1CCC(C)C 159493423 BTAMTKMLECOICT-LLVKDONJSA-N 278.400 3.158 70 20 CGID CN(Cc1cccc(C(F)(F)F)c1)C[C@@H]1CCC[C@@H]1O 159746345 HGGDLFJNFZZSSF-JSGCOSHPSA-N 287.325 3.298 70 20 CGID CSCC[C@H](C)N(C)C(=O)C[C@@H]1CNc2ccccc21 161250344 QMXADYUSXUBEDA-QWHCGFSZSA-N 292.448 3.186 70 20 CGID C[C@H](NC[C@@H](C)N(C)Cc1ccccc1)c1cncs1 160862133 DRPAJBUKHALZNH-KGLIPLIRSA-N 289.448 3.314 70 20 CGID CCC[C@@H](C)CC(=O)Nc1cccc(S(=O)(=O)F)c1 769661201 YKRWHPYTDDHHJF-SNVBAGLBSA-N 287.356 3.110 70 20 CGID CN(Cc1ccccc1Cl)C[C@H](O)Cc1ccccc1 218686756 RBEPMXOAZMYTBJ-MRXNPFEDSA-N 289.806 3.375 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCCOc1ccccc1 217303621 VFCIYGZNHVVBQA-CQSZACIVSA-N 276.380 3.040 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)CCCCCCN)C1 161471704 XZQKVSJQVPEIFS-OAHLLOKOSA-N 268.445 3.180 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)c2ccccc2O)C1 161090649 PLURDVNEWSMHHY-CYBMUJFWSA-N 261.365 3.291 70 20 CGID Cc1cccc(C)c1CSCc1nnnn1C1CC1 161310820 GMEBSHZMZJWLBD-UHFFFAOYSA-N 274.393 3.058 70 20 CGID CC(C)[C@H](NC(=O)NO[C@H]1CCCCO1)c1ccccc1 161491229 ZWICXYQHOAVTHE-GJZGRUSLSA-N 292.379 3.141 70 20 CGID Cc1c(/C=C/C(=O)N(C)[C@H](C)c2cccs2)cnn1C 160018989 VSTASQGNBQVKML-ABZNLYFFSA-N 289.404 3.023 70 20 CGID C[C@H](NCC(C)(C)O)[C@H](C)c1nc2ccccc2s1 160621418 WVLZAICZGAWCSA-QWRGUYRKSA-N 278.421 3.149 70 20 CGID CC[C@@H](C)C(=O)NCCc1csc(C(C)(C)C)n1 160711538 AMPWLAVNXYAIQE-SNVBAGLBSA-N 268.426 3.145 70 20 CGID Cc1cc(C)cc(NC(=O)NCC(C)(C)[C@H](O)C(C)C)c1 160832051 SIHDSCDTOSJSHK-OAHLLOKOSA-N 292.423 3.468 70 20 CGID Cc1cc(NC(=O)C[C@@H]2CCCCC2(C)C)c[nH]c1=O 159845791 YEGHJIFBGWKROL-LBPRGKRZSA-N 276.380 3.228 70 20 CGID Cc1ccc(CN(C)Cc2cnc3ccccn23)s1 159677277 XOJAPNHAIRQDIL-UHFFFAOYSA-N 271.389 3.336 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H](C)c2cnn(C)c2)C1(C)C 159781196 PNXUNUFADUYYCB-AEGPPILISA-N 279.428 3.055 70 20 CGID Cc1ccsc1CCCC(=O)N1C[C@@H](C)OC[C@H]1C 161133197 HEAQUOXXSYDOAY-CHWSQXEVSA-N 281.421 3.015 70 20 CGID C[C@H](NC[C@@H](C)COCc1ccccc1)C1CCOCC1 161315599 PHKNNEDZLWMLMS-CVEARBPZSA-N 291.435 3.244 70 20 CGID CCCc1ccccc1NC(=O)c1cnc2c(c1)ncn2C 160098493 QSIDOXMGOBPGML-UHFFFAOYSA-N 294.358 3.173 70 20 CGID CCc1ccc([C@@H](CO)NC(=O)N[C@H](C)CC(C)C)cc1 160219641 TYZYSBLDFXIYBL-CZUORRHYSA-N 292.423 3.016 70 20 CGID O=c1[nH]c(-c2ccc3c(c2)CCO3)nc2ccc(Cl)cc12 160342162 QSRQUIBLMXDYQC-UHFFFAOYSA-N 298.729 3.178 70 20 CGID O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)N(C1CCCC1)C1CC1 160347444 UQHVDKBIJJWXDA-CZUORRHYSA-N 292.423 3.061 70 20 CGID O=C(NCC1(C2CC2)CCC1)N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 160581907 HHRNTCPUAMHIHX-IXDOHACOSA-N 296.414 3.204 70 20 CGID C[C@H](c1cc2ccccc2o1)N(C)CCn1ccnc1 159688720 RPFZJVXRWPWTLQ-CYBMUJFWSA-N 269.348 3.322 70 20 CGID CCC[C@H](O)CNC(=O)CCC(C)(C)c1ccccc1 159393455 WWHGQFKWMSZMGR-HNNXBMFYSA-N 277.408 3.022 70 20 CGID C[C@H](NCC1(CO)CCCC1)c1ccc2c(c1)CCC2 160091066 WJLKIOHIXKZXJL-AWEZNQCLSA-N 273.420 3.379 70 20 CGID CCSCC[C@H](C)NC(=O)C[C@H]1CNc2ccccc21 160228153 DQCPERHEMMFCKT-STQMWFEESA-N 292.448 3.234 70 20 CGID O=C(CNc1ccccc1)N[C@@H]1C[C@@H]1C1CCCCC1 161065680 KWPAXILKCWTPSX-HZPDHXFCSA-N 272.392 3.184 70 20 CGID CCCn1c(C)nnc1COc1cccc(Cl)c1 161185087 PXIVIYZOQUNPGN-UHFFFAOYSA-N 265.744 3.229 70 20 CGID c1ccc(C[C@H]2CCN(CCCN3CCCCC3)C2)cc1 161232602 GRXPFSWFQUVXSM-LJQANCHMSA-N 286.463 3.427 70 20 CGID CCC[C@H](CC1CCCC1)C(=O)N[C@@H]1CCC[C@H](N)C1 161267294 NSQVCJOOVTUOOU-OWCLPIDISA-N 280.456 3.369 70 20 CGID CCOc1cc(F)ccc1NC(=O)N(C)[C@H]1CCSC1 161288693 YCMCHYUKNURVKO-NSHDSACASA-N 298.383 3.194 70 20 CGID CCCCNc1ccccc1C(=O)NCc1ccncc1 161341145 YNKOFLWMDPKAFF-UHFFFAOYSA-N 283.375 3.224 70 20 CGID CC[C@@H](CO)N[C@H](CC)c1cccc(Cl)c1F 161480099 VNQCNNNUMDJNMV-JOYOIKCWSA-N 259.752 3.291 70 20 CGID CCCCOC(=O)CCN1CCC[C@H]1c1cccc(C)n1 160107342 HHMMRUXCUWXARF-INIZCTEOSA-N 290.407 3.260 70 20 CGID Cc1ccsc1CCCC(=O)Nc1ccccn1 160374043 QMDKGWDCWQOVQE-UHFFFAOYSA-N 260.362 3.413 70 20 CGID C[C@H](NC[C@@H]1CCCC[C@@H]1O)[C@@H](C)c1ccccc1 160489204 DGRDXXGYDLLMOM-OHFALNGGSA-N 261.409 3.319 70 20 CGID CC1(C)C[C@@H](Nc2ccc(C(F)(F)F)cn2)CCO1 160625973 FFUJCUNYXGROQT-JTQLQIEISA-N 274.286 3.470 70 20 CGID CC[C@H](NC(=O)c1cc(C)oc1C)c1c(C)noc1C 160678938 OFRCUGKEZXBFND-ZDUSSCGKSA-N 276.336 3.382 70 20 CGID Cc1ccoc1C(=O)N[C@H](C)CC(=O)c1cccs1 160769601 RSMKLLXLFGHKIH-SNVBAGLBSA-N 277.345 3.041 70 20 CGID CC(C)CCn1ccc(N[C@H](C)c2ccncc2)n1 159872054 OWONQLAOHFDRBD-CYBMUJFWSA-N 258.369 3.497 70 20 CGID N[C@@H](C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1)c1ccccc1 159720433 FZUZTRFPWVVENW-KZNAEPCWSA-N 294.398 3.139 70 20 CGID CC[C@@H](C)OCC(=O)N(C)Cc1cc2ccccc2o1 159928733 ISMFSCRYQGSLSQ-GFCCVEGCSA-N 275.348 3.206 70 20 CGID NC(=O)[C@H](N[C@H]1CCCc2cc(F)ccc21)c1ccccc1 159547066 ZIQLTHIQGKSDSV-DLBZAZTESA-N 298.361 3.019 70 20 CGID Cc1cc(N[C@H]2CCCc3cc(N)ccc32)nc(C)n1 159477370 MPWSQRRHBCNHOO-HNNXBMFYSA-N 268.364 3.165 70 20 CGID Cc1[nH]ncc1CCCNCc1cc(F)cc(Cl)c1 160924174 UIAICEWDKVQTEZ-UHFFFAOYSA-N 281.762 3.233 70 20 CGID CC[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](N)c1ccccc1 217819979 STJPSRULMRQBFB-FVQBIDKESA-N 274.408 3.162 70 20 CGID CCc1ncnc(NCc2ccc(F)cc2F)c1F 217995605 PECBPDZASNXFGP-UHFFFAOYSA-N 267.254 3.068 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@H](C)Cc1ccccc1Cl 161117824 QHGMHSMHCFKTGR-OCCSQVGLSA-N 297.826 3.042 70 20 CGID O=C(CC1C[C@@H]2CC[C@H](C1)N2)N1CCC2(CCCCC2)C1 161197382 GHFMKULLPVKVEA-MQVJKMGUSA-N 290.451 3.090 70 20 CGID CCCC1(CNC(=O)Cc2ccc(O)cc2Cl)CC1 161346287 FQUAXQYTTGUWKP-UHFFFAOYSA-N 281.783 3.285 70 20 CGID CCOC[C@H](O)CN[C@@H](CC(C)C)c1ccccc1C 161378164 AAJPCVMATXGNCY-WBVHZDCISA-N 279.424 3.069 70 20 CGID CC(C)CCNC(=O)[C@H](C)c1c(F)cccc1F 161388207 CTKVLAPHFDZIEI-SNVBAGLBSA-N 255.308 3.231 70 20 CGID O=C(/C=C/c1ccccc1)N[C@H]1CCOC2(CCCC2)C1 161434133 ZINPDQPCVOUNKA-FDMDGMSGSA-N 285.387 3.308 70 20 CGID COc1ccccc1CN(CCO)CCC1CCCC1 160484466 NQNUAQIBDVYQGH-UHFFFAOYSA-N 277.408 3.070 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CC[C@@H](C)C[C@@H]1C 160587874 COWFBQYBNJKVTN-NEPJUHHUSA-N 299.374 3.306 70 20 CGID C[C@H]1CCN(C(N)=O)[C@H]1c1ccc(C(F)(F)F)cc1 160949787 WQOCEFBAFYJSPW-GZMMTYOYSA-N 272.270 3.167 70 20 CGID CCc1cccc(CC)c1NC(=O)[C@H]1CCCCO1 159601817 CGEKBLDFOJOKOB-CQSZACIVSA-N 261.365 3.319 70 20 CGID Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)[C@@H](N)C(C)(C)C)C1 159889585 KQJZQBORIWIDBY-IJEWVQPXSA-N 288.435 3.073 70 20 CGID C[C@@H]1C[C@@H]1C(=O)Nc1cc(F)ccc1OC(F)F 159497661 FISZGPSONBDLGW-SVRRBLITSA-N 259.227 3.022 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccncc1 159923496 KMZHDLIFUYNLGV-NWDGAFQWSA-N 258.346 3.194 70 20 CGID Cc1ccccc1[C@@H](C)NCCC(=O)N1CCCCCC1 159366618 PHXWYHZZFYSDTE-MRXNPFEDSA-N 288.435 3.438 70 20 CGID Cc1cc(C(=O)NCCc2cccs2)cc(C)c1F 160546522 YPRAIMFENYQHOC-UHFFFAOYSA-N 277.364 3.477 70 20 CGID COCCOCCCCNCc1cc(F)cc(Cl)c1 160984591 CJWUBHMBBYTZHS-UHFFFAOYSA-N 289.778 3.012 70 20 CGID COc1ccc2c(c1)CCC[C@@H]2NC[C@H]1CCCN(C)C1 217571482 DSHKQURYYKKANV-KDOFPFPSSA-N 288.435 3.004 70 20 CGID O=C(Nc1cc(F)c(Br)cc1F)C1CCC1 160900925 SAVOPDOAHLQPCP-UHFFFAOYSA-N 290.107 3.466 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H](C)c1ccc(OC)c(F)c1 161171496 LVGRUUAEIDEPQF-DZGCQCFKSA-N 294.414 3.359 70 20 CGID CC[C@H](C)c1cc(C(=O)N(Cc2ccncc2)C2CC2)on1 161476272 PEPZFFCAKSMWQI-LBPRGKRZSA-N 299.374 3.388 70 20 CGID CN1CCC(CN(C)C(=O)C2CCC(C)(C)CC2)CC1 160016843 LFQAAQAZBKPJCI-UHFFFAOYSA-N 280.456 3.003 70 20 CGID O=C(Nc1ccc2c(c1)OCO2)N1CC[C@@H]2CCCC[C@@H]21 160053929 BTQXCONNAZTNGJ-AAEUAGOBSA-N 288.347 3.212 70 20 CGID C[C@@H](NC[C@@](C)(O)c1ccsc1)C1CCCC1 160099831 VZTIHESBASRMNR-BXUZGUMPSA-N 253.411 3.124 70 20 CGID CC(C)CN1C(=O)c2ccccc2N[C@H]1c1ccn(C)c1 160228420 PAAYKZCSZKCBAV-MRXNPFEDSA-N 283.375 3.248 70 20 CGID CCOC[C@H]1CCN(C(=O)C[C@H]2CCCCC2(C)C)C1 160390907 SUCQXAOYNLYNTM-LSDHHAIUSA-N 281.440 3.478 70 20 CGID CC1(NC(=O)NCC(C)(C)c2ccccc2F)CCC1 160394964 GIYYISIPRGFBOK-UHFFFAOYSA-N 278.371 3.345 70 20 CGID CCCC1(CNC(=O)[C@H](OCC)c2ccccc2)CC1 160544436 INJNEHKLCQSAIU-OAHLLOKOSA-N 275.392 3.461 70 20 CGID COC[C@H]1CCCN1C(=O)C[C@@H](C)c1ccc(F)cc1F 160882678 ZAYHBKQPKICQER-DGCLKSJQSA-N 297.345 3.096 70 20 CGID C[C@H](CNC(=O)NC1(C)CCC1)COCc1ccccc1 159913275 YTWMXVQQJBMCMU-CQSZACIVSA-N 290.407 3.081 70 20 CGID COc1cccc([C@@H]2C[C@H]2C(=O)NCC2(C3CC3)CC2)c1 159728363 PCNVGGFVNZEGDQ-JKSUJKDBSA-N 285.387 3.105 70 20 CGID c1ccc(CCCCN[C@H]2CCN3CCC[C@@H]3C2)cc1 159898302 MBDZQJDRLZVXAV-ZWKOTPCHSA-N 272.436 3.226 70 20 CGID COc1cc(N[C@@H]2CCC[C@@H]2[C@@H]2CCCN2)ccc1F 160040552 LZTAKDPIZFZEMJ-VHDGCEQUSA-N 278.371 3.167 70 20 CGID CC[C@@H]1CCCC[C@@H]1NC(=O)C[C@@H](N)c1ccccc1 217819805 STJPSRULMRQBFB-BMFZPTHFSA-N 274.408 3.162 70 20 CGID COC(=O)c1csc(NC(=O)Nc2ccc(C)cc2)c1 161014650 MZJMOZOUJUUGEX-UHFFFAOYSA-N 290.344 3.487 70 20 CGID CC(C)NCCC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1F 161043531 FCMYFEHSUUOOIN-BBRMVZONSA-N 292.398 3.123 70 20 CGID CC(C)Oc1cncc(C(=O)N2CCC[C@@H]3CCC[C@H]32)c1 161318884 CTFIVJKUOPKJSD-XJKSGUPXSA-N 288.391 3.274 70 20 CGID CCCCNc1ccccc1C(=O)NC[C@H](O)[C@H](C)CC 160039692 NBQXPFPSFSGGBZ-CJNGLKHVSA-N 292.423 3.035 70 20 CGID Cc1noc(C)c1CCSCc1nc(CC(C)C)no1 160124846 VEUHMPGBVXFSBV-UHFFFAOYSA-N 295.408 3.349 70 20 CGID C[C@H](CC(=O)Nc1cnc(C(C)(C)C)nc1)c1ccncc1 160239153 RVDLGIKONSWSSV-GFCCVEGCSA-N 298.390 3.301 70 20 CGID Cc1ccc2c(c1)[C@H](NC(=O)N[C@@H](C)CC(C)C)CO2 160531417 GNUHIRPPISAUNM-GXTWGEPZSA-N 276.380 3.162 70 20 CGID CCOc1ccc(NC(=O)C[C@H](C)SC)cc1F 160586374 FQCIZGKBVMJJLE-VIFPVBQESA-N 271.357 3.305 70 20 CGID Cc1cccc([C@@H]2CCCN2C(=O)C[C@@H]2CCCN2)c1C 160723059 RGETZEVAEQYHSL-RDJZCZTQSA-N 286.419 3.109 70 20 CGID C[C@H]1COc2ccccc2N1Cc1cnc2ccccn12 160868350 NZDDZQWESMWWKB-ZDUSSCGKSA-N 279.343 3.122 70 20 CGID CC[C@H]1CCN(C(=O)c2cnn(CC(C)C)c2C2CC2)C1 159430211 JAHOLLHCASZAAO-ZDUSSCGKSA-N 289.423 3.289 70 20 CGID Cc1noc(C)c1[C@@H](C)CNC(=O)N[C@H]1CCCC1(C)C 159462396 YQRBUZWOZKXMJL-GWCFXTLKSA-N 293.411 3.273 70 20 CGID CCOc1cccc(CNC(C)(C)c2ncc(C)s2)n1 159700200 XVZQYJDLTLNNHU-UHFFFAOYSA-N 291.420 3.270 70 20 CGID CCCCOCC(=O)Nc1cc(F)ccc1OC(F)F 159371232 TWJYHTJSJLSPCC-UHFFFAOYSA-N 291.269 3.182 70 20 CGID CN(Cc1cc2ccccc2nc1Cl)[C@@H](CN)C1CC1 160099328 JCTNBNCVJXVLEZ-HNNXBMFYSA-N 289.810 3.057 70 20 CGID CNC(=O)c1cccc(NCc2cc(F)cc(Cl)c2)c1 160814582 DEVNHGTUFJLSFT-UHFFFAOYSA-N 292.741 3.451 70 20 CGID CCCC[C@@H](C)C(=O)Nc1cccc(S(=O)(=O)F)c1 799987681 GAXSUPGSONUHLB-SNVBAGLBSA-N 287.356 3.110 70 20 CGID CC(C)CCOCCNCc1cccc2cc[nH]c12 218162040 QEIBRJGOQHBAEF-UHFFFAOYSA-N 260.381 3.320 70 20 CGID CCc1noc(C)c1C[S@](=O)c1cc(C)ccc1C 161039566 JBAQSKZNMUWQHE-LJQANCHMSA-N 277.389 3.470 70 20 CGID COc1cc(F)c(C(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC 161286946 BUPNIGWXLMYBKE-GXFFZTMASA-N 295.354 3.151 70 20 CGID CCOCCCC(=O)N(C)[C@H]1CCCC[C@@H]1CC 161298045 KLLQIHKBBOQZAQ-KBPBESRZSA-N 255.402 3.230 70 20 CGID O=C(Nc1cnc(-c2ccccc2)nc1)C1=CCCC1 160229024 ODUMYWMCDZOUAV-UHFFFAOYSA-N 265.316 3.192 70 20 CGID CC(C)(O)CN[C@@H]1CCCCc2ccc(Cl)cc21 160623834 JPGVPHBLNPHSGQ-CQSZACIVSA-N 267.800 3.468 70 20 CGID O=C(/C=C/c1ccc(Cl)nc1)NC[C@@H]1CC=CCC1 160708130 USLLPZCLKREQRE-YPUOHESYSA-N 276.767 3.221 70 20 CGID CN1CCc2nc(NC(=O)C3(C)CCCCC3)sc2C1 160934309 QEPLWQXPHHSHGI-UHFFFAOYSA-N 293.436 3.040 70 20 CGID C[C@H](NC(=O)c1cc(F)cc(Cl)c1O)c1cccnc1 159544027 GSTTZQYNFFKFCD-QMMMGPOBSA-N 294.713 3.071 70 20 CGID Cc1cc(CNC(=O)NCCc2ccco2)ccc1Cl 159561412 WXKVYGINFVEFGB-UHFFFAOYSA-N 292.766 3.283 70 20 CGID CCCn1nccc1CN[C@H](C)c1cc(C)oc1C 160126244 JCWMKLIKNYVYQC-GFCCVEGCSA-N 261.369 3.354 70 20 CGID Cc1cccc([C@H]2CCCN2CCOCC(F)(F)F)n1 160420513 CDONEUNQUWDHOB-CYBMUJFWSA-N 288.313 3.106 70 20 CGID CC[C@H](N[C@H](C)c1nnc(C)o1)c1ccc(F)cc1F 161002324 OARDBOKMIDSOEQ-OQPBUACISA-N 281.306 3.458 70 20 CGID CCO[C@H]1CCCN(C(=O)C(C)(C)C2CCCC2)C1 161099625 GGIXAOBTDQMTRH-AWEZNQCLSA-N 267.413 3.230 70 20 CGID Cc1cc(C)cc(CN2CCN(Cc3ccncc3)CC2)c1 161198592 YBYXOWCGHKYLLT-UHFFFAOYSA-N 295.430 3.016 70 20 CGID CC[C@](C)(NCCCN1CCCCC1)c1nccs1 161433406 ZKXWHELOLMELNX-HNNXBMFYSA-N 281.469 3.234 70 20 CGID C[C@@H](C(=O)N[C@@H]1CCOC2(CCCC2)C1)c1ccsc1 160256486 NWKTZVPHGQZAJO-TZMCWYRMSA-N 293.432 3.460 70 20 CGID CC[C@H](NCCSc1ccccc1)c1cnn(C)c1 160511689 IBISPDNUGMEAAP-HNNXBMFYSA-N 275.421 3.253 70 20 CGID CCOc1cccc(CN[C@H](C)c2cnc(C)nc2C)c1 159388877 WKOUFPHJSPUCGF-GFCCVEGCSA-N 285.391 3.343 70 20 CGID CC(C)=CCOC(=O)c1cnn(Cc2ccccc2)c1 217404221 CDZKKVYGEPGFEA-UHFFFAOYSA-N 270.332 3.054 70 20 CGID c1ccc2oc(CN[C@@H]3CCN4CCCC[C@@H]34)cc2c1 217631556 KLWNHHHVIAAOIX-CVEARBPZSA-N 270.376 3.149 70 20 CGID CCOC(=O)NCCCC(=O)Nc1c(C)cc(C)cc1C 160063370 XHDTXCNPLNIWTB-UHFFFAOYSA-N 292.379 3.077 70 20 CGID O=C(CCC(=O)c1cccs1)NCC1(C2CC2)CC1 160165425 BMUCQSCZADCHBQ-UHFFFAOYSA-N 277.389 3.017 70 20 CGID O=C(N[C@H]1CCSc2c(F)cccc21)[C@@H]1CCCCO1 160307804 KPKVXIQJMMCRGL-STQMWFEESA-N 295.379 3.048 70 20 CGID CCCC[C@@H](CC)C(=O)N(C)Cc1cccn1C 160458735 ZGPICXUNPDWCBA-CYBMUJFWSA-N 250.386 3.200 70 20 CGID Cc1ccc(NC(=O)N[C@@H](C)C2CCC2)cc1F 159418864 UOJCMJHNUKKCHW-JTQLQIEISA-N 250.317 3.444 70 20 CGID CCOC[C@H]1CCCN(c2nc(C(C)(C)C)ns2)C1 159478009 UOJRLYDBLUGURB-NSHDSACASA-N 283.441 3.089 70 20 CGID CC(C)(C)[C@@H]1CCN(C(=O)CC[C@H](N)c2ccccc2)C1 159500639 ZMBILOBNFGLLGL-CVEARBPZSA-N 288.435 3.361 70 20 CGID Cc1cc(C)cc(CCN[C@@H]2CCCc3c2cnn3C)c1 159514146 SZBJJXXUEARTRZ-QGZVFWFLSA-N 283.419 3.247 70 20 CGID Cc1nc(CCN[C@@H](C)c2ccccn2)sc1C 159387896 CCIAKGXZFZUJJO-NSHDSACASA-N 261.394 3.048 70 20 CGID COc1cccc([C@@H](C)NC[C@@H]2CCC(C)(C)O2)c1 160325024 JDAFLXKXSUYLKJ-DOMZBBRYSA-N 263.381 3.303 70 20 CGID CCCCOC(=O)CCN[C@@H](c1ccccc1)C1CC1 218173999 JFQQVRYVIIRRTK-KRWDZBQOSA-N 275.392 3.461 70 20 CGID CCN(CCN[C@@H](C)c1cscn1)C(=O)OC(C)(C)C 218240374 ISVTUSRMPJZKEI-NSHDSACASA-N 299.440 3.051 70 20 CGID O=S(=O)(Cl)c1ccc2[nH]c3ccccc3c2c1 100593340 YZPNVCJKKPZEIA-UHFFFAOYSA-N 265.721 3.249 70 20 CGID Cc1cc(C(=O)N2CCSc3ncccc32)oc1C 160843576 XPBXOSGNRWDSMX-UHFFFAOYSA-N 274.345 3.044 70 20 CGID CCC(CC)c1cc(C(=O)NCc2cccc(C)n2)on1 161143381 WIRAHTHWTYXAST-UHFFFAOYSA-N 287.363 3.212 70 20 CGID Cc1cnc(NC(=O)N2CC[C@@H]3CCCC[C@@H]32)s1 160044401 PWPNTRYZXLVVIM-QWRGUYRKSA-N 265.382 3.248 70 20 CGID O=C(O[C@@H](c1ccccn1)C(F)(F)F)C1CC=CC1 160115050 UTYKWZCSHAVRGK-NSHDSACASA-N 271.238 3.194 70 20 CGID FC(F)(F)c1cccc(N[C@H]2CCO[C@H](C3CC3)C2)n1 160297469 SZFKUITZZAKGJW-QWRGUYRKSA-N 286.297 3.470 70 20 CGID C[C@H](NCc1ccccc1CN1CCOCC1)C(C)(C)C 160488414 MNAWCJGPJZMSAO-HNNXBMFYSA-N 290.451 3.043 70 20 CGID CCc1c(Cl)nc(C)nc1N[C@@H]1CCOC(C)(C)C1 160686841 NQFGEEDPHAVABK-SNVBAGLBSA-N 283.803 3.370 70 20 CGID CCOc1cc(C)ccc1NC(=O)CO[C@H](C)CC 159464140 OJPYXAWNYCHONH-GFCCVEGCSA-N 265.353 3.147 70 20 CGID Cc1cc(NC(=O)[C@@H](C)c2cc3ccccc3o2)c[nH]c1=O 159482813 MALQITBOFFKZPW-NSHDSACASA-N 296.326 3.172 70 20 CGID CCOC(C)(C)CNC(=O)CCc1c[nH]c2ccccc12 159697244 WFSRASUKMAQLGZ-UHFFFAOYSA-N 288.391 3.032 70 20 CGID CC1(C)C(C(=O)N[C@@H]2CCOC3(CCCC3)C2)C1(C)C 159900515 PQIUHPQHUUPNTM-GFCCVEGCSA-N 279.424 3.277 70 20 CGID Cc1cc(C)cc(NC(=O)N(C)[C@@H]2CCSC2)c1 159397191 UJMWSPAPGIKPAT-CYBMUJFWSA-N 264.394 3.273 70 20 CGID C[C@@H](c1c(F)cccc1F)N(C)C[C@@H]1CCC[C@@H]1O 159596236 DAWYCSJAJNBEDU-MJVIPROJSA-N 269.335 3.119 70 20 CGID Cc1c(CN[C@@H]2CCc3cc(Cl)ccc32)cnn1C 161215237 ALEQPCJSYWDNAR-OAHLLOKOSA-N 275.783 3.159 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(F)ccc1F 159740472 WZSZROSSMMPPFQ-NOZJJQNGSA-N 253.292 3.273 70 20 CGID CC(C)n1ccnc1CN(C)Cc1cccc(F)c1 160686122 JJVDUGDLTDIZOM-UHFFFAOYSA-N 261.344 3.235 70 20 CGID CC[C@@H](COCCC(C)(C)C)CS(=O)(=O)Cl 116968320 GDMQOEYTPBLTPV-JTQLQIEISA-N 270.822 3.034 70 20 CGID CC1(C)CC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 776364023 PMEWDPSRKUSMEL-SNVBAGLBSA-N 299.367 3.110 70 20 CGID CC[C@H](C)NCc1ccccc1I 218500360 ZPSFQHBDHFIRMZ-VIFPVBQESA-N 289.160 3.179 70 20 CGID O=C(Cc1c[nH]c2ccccc12)N1[C@H]2C=CC[C@H]1CC2 218738839 KBBSLMSHWQMLER-KBPBESRZSA-N 266.344 3.030 70 20 CGID C[C@H](c1cccc2ccccc12)N1CCC[C@@H](N)C1 217491959 PNTPXZZIXQNRDM-UKRRQHHQSA-N 254.377 3.324 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1cccc(F)c1 217696621 AUDJPNAJVXHOJZ-RCBQFDQVSA-N 262.372 3.103 70 20 CGID COCC(C)(C)C(=O)Nc1ccc(-c2nccs2)cc1 161119069 TUCHXEIITKXPFE-UHFFFAOYSA-N 290.388 3.421 70 20 CGID Cc1ccccc1[C@H](C)SCc1nnnn1C1CC1 161210332 HECMCOIYQCNFPZ-NSHDSACASA-N 274.393 3.311 70 20 CGID CSc1ccc(NC(=O)N(C)[C@H]2CCSC2)cc1 160115956 WMOABIBSGLANTP-NSHDSACASA-N 282.434 3.378 70 20 CGID O=C(N[C@@H]1CCSc2ccc(F)cc21)[C@@H]1CCCCO1 160290526 RDFYBCDABKCHLD-OLZOCXBDSA-N 295.379 3.048 70 20 CGID CN(Cc1cccn1C)C(=O)CCc1c[nH]c2ccccc12 160431433 WHWQNZLZULGSQA-UHFFFAOYSA-N 295.386 3.098 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@H]1C[C@@H]1C1CC1 160457466 FPJQHUIVMARMDK-KFWWJZLASA-N 277.408 3.031 70 20 CGID COc1cccc(Cl)c1CC(=O)N1C[C@H]2CCC[C@@H]2C1 160626534 HSCVWMWNPDYOQM-VXGBXAGGSA-N 293.794 3.150 70 20 CGID CCCCn1ncc(C(=O)N(CC(C)C)C2CC2)c1C 160908634 XGBIRGBDLROBCM-UHFFFAOYSA-N 277.412 3.252 70 20 CGID CC(C)NC(=O)CN[C@@H]1CCCCc2ccc(Cl)cc21 160959524 MNQGCCAWISKCGO-OAHLLOKOSA-N 294.826 3.222 70 20 CGID Cc1ccc(CCNc2nc(C(C)(C)C)ns2)cn1 159426036 WBIMZSVACOXOLK-UHFFFAOYSA-N 276.409 3.194 70 20 CGID CCc1ncnc(N2CCc3c(Cl)cccc3C2)c1F 159934811 COKQVGVKYCGFII-UHFFFAOYSA-N 291.757 3.394 70 20 CGID Cc1nccc(NC(=O)NCCc2ccco2)c1Cl 159788692 CHFPCMBKGWMMIT-UHFFFAOYSA-N 279.727 3.001 70 20 CGID Cc1ncsc1CCNCc1cccc2cccnc12 159416161 RJCRFIOVSAGTOF-UHFFFAOYSA-N 283.400 3.332 70 20 CGID c1ccc(CN(CCOCC2CC2)C[C@H]2CCCO2)cc1 159548804 TVSOHIQESYALCP-GOSISDBHSA-N 289.419 3.094 70 20 CGID CC[C@H](C)NCc1ccccc1OCCN(CC)CC 160296501 LZZHEPKWILGZAA-HNNXBMFYSA-N 278.440 3.295 70 20 CGID Cc1noc(C2CCN(CCC3CCCC3)CC2)n1 159494678 OYNJLDDXTSXTSS-UHFFFAOYSA-N 263.385 3.138 70 20 CGID O=S(=O)(Cl)CCCCOc1ccc(Cl)cc1 100495419 NVUDYEVAXJPQCS-UHFFFAOYSA-N 283.176 3.068 70 20 CGID CC(C)Cc1ccc(CCC(=O)N(C)CC[C@@H](C)O)cc1 160129654 OKAVIDOOCQJOSF-OAHLLOKOSA-N 291.435 3.047 70 20 CGID CC1(C)CCCC[C@@H]1CC(=O)NC[C@H]1CCN(C2CC2)C1 160133272 XLFABQJVMFXJTB-HUUCEWRRSA-N 292.467 3.193 70 20 CGID C[C@@H](C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccsc1 160235979 IOHKEAHNFZMWKJ-QMTHXVAHSA-N 287.384 3.361 70 20 CGID CC(C)(O)CCNC1(Cc2ccccc2)CCCC1 160253695 ISZDDRQIYCKZTR-UHFFFAOYSA-N 261.409 3.293 70 20 CGID Cc1cc(Cl)ncc1NC(=O)N(C)CCC1CC1 160554828 KIZIXUCZTPMLRW-UHFFFAOYSA-N 267.760 3.307 70 20 CGID CC[C@@H](N[C@@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1F 160928037 OTYCPFVNTOXFEB-HUUCEWRRSA-N 296.361 3.015 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cccc(-c2nnco2)c1 160990611 RRXJTDQJTOBLMV-DOMZBBRYSA-N 271.320 3.111 70 20 CGID CC(C)(CNC(=O)c1ccc(N)cc1)Cc1ccccc1 159486839 ODJKVXWAKUJYIC-UHFFFAOYSA-N 282.387 3.268 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)CSCc1cccnc1 159513999 YJYNMLBQIKGULS-KBPBESRZSA-N 278.421 3.010 70 20 CGID C[C@@H](CNc1ccccc1)NC(=O)C[C@H](C)c1ccncc1 159584162 FTIVZWIDSZFJAJ-GJZGRUSLSA-N 297.402 3.192 70 20 CGID C[C@@H](NC1CCN(C2CCCC2)CC1)c1cncs1 160473665 DXBTYDVUBOZHMX-GFCCVEGCSA-N 279.453 3.201 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1F 161038131 NFXMAOUGOGQYBE-YUTCNCBUSA-N 282.378 3.488 70 20 CGID COC(=O)C1(NCC2CCCCC2)CCCCC1 217096907 VOTKENLQNGRLMO-UHFFFAOYSA-N 253.386 3.032 70 20 CGID CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239063 UULCNNAGSCGARF-MFKMUULPSA-N 299.367 3.110 70 20 CGID O=S(=O)(Cl)c1cc(-c2ccc(C3CC3)cc2)no1 521400266 HQLTXLSPFNWDRL-UHFFFAOYSA-N 283.736 3.147 70 20 CGID C[C@H]1CC[C@H](C)N1CC1CCN(C(=O)C(C)(C)C)CC1 160148743 NXHTZBLPDVDNOP-KBPBESRZSA-N 280.456 3.144 70 20 CGID C[C@H](N[C@@H]1CCN(C2CCCCC2)C1=O)c1ccccc1 160156752 OSGKUNZRCXNAGJ-WMLDXEAASA-N 286.419 3.271 70 20 CGID CCOc1cccc([C@H](C)NC[C@@H]2CCCC[C@@H]2O)c1 160539814 BLPHMKMXJINTCO-QRTARXTBSA-N 277.408 3.287 70 20 CGID CS[C@@H](C)CC(=O)Nc1nc(-c2ccccc2)ns1 160830159 DJQBHYMCUFWYQW-VIFPVBQESA-N 293.417 3.285 70 20 CGID CN(CCC1CC1)C(=O)NCCC1=CCCCC1 160907660 SPYRGUKSQACLJM-UHFFFAOYSA-N 250.386 3.318 70 20 CGID Cc1ccc(C)c(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1 160915812 HSFLJYTWQGICTA-GOEBONIOSA-N 288.391 3.383 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1C[C@@H]1C1CC1 159815838 CQRFHOHQMSLUSE-JHJVBQTASA-N 261.390 3.288 70 20 CGID CC[C@@H](NCCc1cc(C)cc(C)c1)c1cnn(C)c1 159455119 JLVXCZYZSYHXJU-QGZVFWFLSA-N 271.408 3.320 70 20 CGID O=C(CCOc1ccc(Cl)cc1)NCC1(C2CC2)CC1 159678089 UIQWPYKCLREUMQ-UHFFFAOYSA-N 293.794 3.415 70 20 CGID CN(CCc1nccs1)C(=O)Nc1ccc(F)cc1F 159883199 DIGSBHYEUTYWFC-UHFFFAOYSA-N 297.330 3.128 70 20 CGID Cc1cc(F)cc(NC(=O)N[C@@H](CO)CC(C)(C)C)c1 159511163 PXXMNVIQCZSRJO-CYBMUJFWSA-N 282.359 3.053 70 20 CGID C[C@@H](N[C@@H]1CCCc2cc(F)ccc21)C(=O)NC(C)(C)C 159539684 RGAKDKWHGVPGOX-IAQYHMDHSA-N 292.398 3.096 70 20 CGID COc1cccc2cc([C@@H](C)NCCc3cnn(C)c3)oc12 159756269 CMNHQKPZORHRHR-GFCCVEGCSA-N 299.374 3.068 70 20 CGID CC(=O)C[C@@H](C)NC(=O)c1occc1-c1ccccc1 159964665 KGSQYTZXFPQDJM-LLVKDONJSA-N 271.316 3.044 70 20 CGID Cc1cccc(C(=O)NC[C@H]2Cc3ccccc32)c1F 161479588 AJGOGOYHCMVTSF-CYBMUJFWSA-N 269.319 3.204 70 20 CGID CCSCCN1CCC(OCCc2ccccc2)CC1 159714824 NCKQFTYUJXHZLZ-UHFFFAOYSA-N 293.476 3.463 70 20 CGID C[C@@H]1CCN(C(=O)c2ccnc(F)c2)[C@H]2CCCC[C@H]21 217583220 IALUHCDMPVPHBC-XBFCOCLRSA-N 276.355 3.262 70 20 CGID CCc1noc(C)c1CSCCC(=O)N1CCC[C@H]1C 160052176 NPKMBFOILPNMFK-LLVKDONJSA-N 296.436 3.180 70 20 CGID COC(=O)c1ccc(F)c(NC(=O)N[C@@H](C)CC(C)C)c1 160106524 WQJQQHSGOSTUPK-JTQLQIEISA-N 296.342 3.168 70 20 CGID CC(C)/N=c1/ccccn1C(=O)c1ccc(C(C)C)nc1 160572981 MIBNBQHPPXZXKK-MNDPQUGUSA-N 283.375 3.004 70 20 CGID COc1cccc([C@H](CNc2ccnc(C)c2)N(C)C)c1 160915134 WYESYOKWXRXBRH-KRWDZBQOSA-N 285.391 3.113 70 20 CGID C[C@H]1CCC[C@H](NC(=O)N(CCN(C)C)C2CCCC2)C1 160916722 FIOHJXPGPGGIQJ-GJZGRUSLSA-N 295.471 3.081 70 20 CGID CCS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)CC2CC2)cc1 159503339 VCYQTRXNBNGRJE-STQMWFEESA-N 295.448 3.319 70 20 CGID Cc1cccc(CCNC(=O)N[C@H]2CCCC[C@@H]2C)c1 217406524 ORMTVBCLYSPKSQ-HOCLYGCPSA-N 274.408 3.415 70 20 CGID CC(C)[C@H](COCc1ccccc1)CS(=O)(=O)Cl 114476895 KUOTWXTUYYEFEL-CYBMUJFWSA-N 290.812 3.044 70 20 CGID CCCC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 799985685 HEIPUPDLFAHIQV-JTQLQIEISA-N 287.356 3.110 70 20 CGID CC(=O)NC1CCC(Nc2cccc3cccnc23)CC1 161322971 OJEYSPXDXVSTAD-UHFFFAOYSA-N 283.375 3.094 70 20 CGID Cc1ccc(NC(=O)N[C@H](C)c2nc3ccccc3[nH]2)cn1 161380825 KOWWFUKTUQYRLL-LLVKDONJSA-N 295.346 3.149 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cnc(-c2ccccn2)s1 161485818 AFVWEXYODSKUOD-QWRGUYRKSA-N 287.388 3.218 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(Cn2cccn2)cc1 160181914 QSJLEEUZVAUCBT-GFCCVEGCSA-N 289.404 3.012 70 20 CGID CCC(CC)C(=O)Nc1ccc(C(=O)NC)cc1Cl 160214322 XYZRWIXHKXIRQJ-UHFFFAOYSA-N 282.771 3.074 70 20 CGID CC(C)Oc1cncc(C(=O)N[C@@H]2CCc3ccccc32)c1 160307768 UOFUUAZRZKYOSW-QGZVFWFLSA-N 296.370 3.286 70 20 CGID CC1(NC(=O)NCc2cccc(OC(F)F)c2)CCC1 160328242 LOMZXPFKJCWLNJ-UHFFFAOYSA-N 284.306 3.030 70 20 CGID CCCCN(CC)C(=O)Nc1ccn(CC(F)(F)F)n1 160514370 NJNHLUXJODBUGM-UHFFFAOYSA-N 292.305 3.099 70 20 CGID Cc1ccc(C(=O)N(C)Cc2cccn2C)cc1Cl 160717386 VYHCMHVXTJGQKX-UHFFFAOYSA-N 276.767 3.259 70 20 CGID CC(C)(C)c1nc(CCNC(=O)CCC2CC2)cs1 160741988 WQZYUTUMASPGME-UHFFFAOYSA-N 280.437 3.290 70 20 CGID Cc1noc(C)c1[C@@H](C)CNC(=O)N[C@@H]1CCCC1(C)C 159462121 YQRBUZWOZKXMJL-GXFFZTMASA-N 293.411 3.273 70 20 CGID Cc1cccc(C(=O)N[C@H](CN)C2CCCCC2)c1Cl 160403248 WSYNKAHMDNFPCP-CQSZACIVSA-N 294.826 3.286 70 20 CGID C[C@H]1C[C@@H](C)CN(Cc2csc(C3CC3)n2)C1 161262062 JBYWRRFYIKGKSB-PHIMTYICSA-N 250.411 3.498 70 20 CGID CCOc1cc(F)ccc1NC1CCC(NC(C)=O)CC1 161114130 OICLRCXPDKOPJC-UHFFFAOYSA-N 294.370 3.084 70 20 CGID CC[C@H](C)Oc1ccc(C(=O)N[C@@H](CO)CC(C)C)cc1 161231999 VGPBAJJJSKCBED-DZGCQCFKSA-N 293.407 3.001 70 20 CGID CCN1CC[C@H](NCC2(c3ccc(F)cc3)CC2)[C@H](C)C1 161355483 HPEVQKMFMMOKSM-PBHICJAKSA-N 290.426 3.177 70 20 CGID COc1c(F)cc(NC(=O)C[C@@H](C)SC)cc1F 160603894 OSBHVZWMFUXNHC-SSDOTTSWSA-N 275.320 3.054 70 20 CGID Cc1cscc1CNC(=O)NC1CCCCC1 160697761 GQGKIFHEMUJGKP-UHFFFAOYSA-N 252.383 3.188 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)c1nc2ccccc2o1 160724716 IRCWKHVJFXHKBY-ZUZCIYMTSA-N 258.321 3.227 70 20 CGID CCOCCC1(C(=O)N[C@H]2CCCC[C@@H]2C)CCC1 160954090 LTKBWGSCWNYRQT-KBPBESRZSA-N 267.413 3.278 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccnn1Cc1ccccc1 159845166 VPBNSEINBRJWPY-YOEHRIQHSA-N 283.375 3.306 70 20 CGID CCCn1ccc2ccc(NC(=O)C[C@H]3CCCN3)cc21 159854077 PHQVGSCIUSTGAY-CQSZACIVSA-N 285.391 3.132 70 20 CGID COc1ccc(CN(C)Cc2cnc3cc(C)ccn23)cc1 159858058 NCOOFGMPXVIMSX-UHFFFAOYSA-N 295.386 3.283 70 20 CGID O=C(Cc1cc2c(ccc3ccccc32)o1)NC1CC1 159875744 FYOXSTBWUFIBQM-UHFFFAOYSA-N 265.312 3.407 70 20 CGID CC[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)C(=O)OC 159514107 FFSZZRJEONIMIV-BXKDBHETSA-N 289.297 3.308 70 20 CGID CCO[C@H]1C[C@@H](Nc2ccc(F)c(OC)c2)C1(C)C 160103922 QOBKMTLBXUZRNH-KGLIPLIRSA-N 267.344 3.450 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(F)ccc1F 159740201 WZSZROSSMMPPFQ-RNCFNFMXSA-N 253.292 3.273 70 20 CGID C[C@@H]1SCCN(c2nc(C(C)(C)C)ns2)[C@H]1C 159550061 DLGCYTNTLMPQPM-IUCAKERBSA-N 271.455 3.166 70 20 CGID CC(C)COc1ccc(S(=O)(=O)Cl)cc1Cl 100573260 XNDZHMVVTLKVQO-UHFFFAOYSA-N 283.176 3.302 70 20 CGID CN(C)[C@H]1CCC[C@@H](N[C@@H]2CCCOc3ccccc32)C1 161092030 LEKPSWFVYIVIEN-HLLBOEOZSA-N 288.435 3.363 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CCC(=O)N(CC)CC 161209478 VNYHDWMSQZAWFL-HUUCEWRRSA-N 296.455 3.062 70 20 CGID Cc1cc(C(=O)Nc2ccc(C)c(C(F)(F)F)c2)ncn1 161352931 KWBHMGMYXIHQKW-UHFFFAOYSA-N 295.264 3.365 70 20 CGID CCCOCc1ccccc1CNC(=O)C[C@H](C)SC 160143491 ARSVUHLURYWDCL-ZDUSSCGKSA-N 295.448 3.371 70 20 CGID CC(=O)c1ccc(C(=O)OCc2nc(C)sc2C)cc1 160242271 FVVVWJXOUSZCIJ-UHFFFAOYSA-N 289.356 3.320 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)NC(C1CC1)C1CC1 160433408 LXDYCAZHVZDWBN-CHWSQXEVSA-N 275.417 3.465 70 20 CGID CC(C)n1cccc1C(=O)N1CCc2ccccc2C1 160466017 DHBJGBYCVRUSNX-UHFFFAOYSA-N 268.360 3.268 70 20 CGID CCn1cc([C@@H](C)NC[C@H]2CCc3ccccc32)cn1 160982031 ZWYVQYHCWZRUMX-UKRRQHHQSA-N 269.392 3.284 70 20 CGID Cc1cc([C@H](C)NC(=O)N2CCO[C@H](C)[C@@H]2C)c(C)s1 159833571 XVHSSKSHPXOPJW-SDDRHHMPSA-N 296.436 3.245 70 20 CGID COc1ccc(N(C)C(=O)c2cc(F)cc(F)c2)cc1F 159472132 GFZZZLWBKKRDES-UHFFFAOYSA-N 295.260 3.389 70 20 CGID CCc1nnc(SCc2noc(C3CCCCC3)n2)[nH]1 159528852 KDFXLTCBFQIIGU-UHFFFAOYSA-N 293.396 3.090 70 20 CGID CCC(CC)c1cc(C(=O)Nc2ccccn2)on1 159539365 CBPGAXJXSXCLMV-UHFFFAOYSA-N 259.309 3.226 70 20 CGID CCN(CC)C[C@@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159745759 GQXGPQMQWARZMJ-LBPRGKRZSA-N 296.484 3.004 70 20 CGID Cc1nccn1CCCCN1CC[C@H](c2ccccc2)C1 159783326 IXOPFFQXFLJLRZ-SFHVURJKSA-N 283.419 3.461 70 20 CGID Cc1ccccc1[C@@H](C)N[C@H]1CCN(c2ncccc2F)C1 159788353 TVZZMDCWINJTOY-CABCVRRESA-N 299.393 3.459 70 20 CGID O=C(Nc1ccc(-c2nccs2)cc1)[C@@H]1CCCCO1 159980885 BRSDZUIAKAYSCH-ZDUSSCGKSA-N 288.372 3.318 70 20 CGID Cc1cccc(C(=O)NCCc2ccc(O)cc2)c1Cl 160367507 PQWDKRQAAUGBPV-UHFFFAOYSA-N 289.762 3.327 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@@H]2CCCC[C@H]2OC)c1 218189732 LCQOKWZYZBZUCG-XGWLTEMNSA-N 293.407 3.312 70 20 CGID COCCCCCN1CCC[C@H]1c1cccc(C)n1 159831260 WOVCQNFMTWUFRW-INIZCTEOSA-N 262.397 3.344 70 20 CGID CC[C@H](C)N(C)CCNCc1ccccc1OC(C)C 217375095 NQSZTNCDQADCMN-HNNXBMFYSA-N 278.440 3.294 70 20 CGID CCCC[C@H](CC)CNC(=O)NCc1ccccc1CO 161119099 QATJUJUFGNFYSI-AWEZNQCLSA-N 292.423 3.195 70 20 CGID CN(C(=O)c1ccc(F)cc1C(F)(F)F)C1CCC1 161142554 PKVYEDSIJGAPBX-UHFFFAOYSA-N 275.245 3.469 70 20 CGID C[C@H](C(=O)N1CCCC[C@@H]1C)c1c(F)cccc1F 161149267 BXCXINRIBWGVLP-QWRGUYRKSA-N 267.319 3.469 70 20 CGID CC1(NC(=O)NCc2ccccc2OCC2CC2)CCC1 161451002 YHPJBFVZPKCYIG-UHFFFAOYSA-N 288.391 3.217 70 20 CGID CC[C@H]1C[C@H](C(=O)N[C@@H]2CCCc3sccc32)CCO1 160012708 IAVVYPOCLGWQCA-MBNYWOFBSA-N 293.432 3.447 70 20 CGID CCc1nc(CC(=O)OCc2nc(C)sc2C)cs1 160679327 KFAYRHJGCPLHNR-UHFFFAOYSA-N 296.417 3.065 70 20 CGID C[C@@H](C(=O)N(C)Cc1ccco1)c1c(F)cccc1F 160835930 OQOGASIYRQAPDI-SNVBAGLBSA-N 279.286 3.320 70 20 CGID CC[C@H](C)CN(C)CC1CCN(C(=O)C(C)(C)C)CC1 159611477 BWJLUZPRLIQKFT-AWEZNQCLSA-N 282.472 3.249 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)N(CC)CC 159963638 HJOKGFFYIIIMFY-LLVKDONJSA-N 284.425 3.036 70 20 CGID Cc1nc(COC(=O)CCc2c(C)noc2C)c(C)s1 159388511 DUNHSCOSHJTDLC-UHFFFAOYSA-N 294.376 3.041 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)CSCc1ccncc1 159596064 QZVWOMZLYHQWNQ-UONOGXRCSA-N 278.421 3.010 70 20 CGID Cc1cnc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)nc1C 160230935 NUJNPPSSSDNWSE-WMLDXEAASA-N 296.418 3.026 70 20 CGID O=C(Nc1ccc(F)c(F)c1F)N1CCCCC1 160326056 VNSYMPFJOQGBIR-UHFFFAOYSA-N 258.243 3.122 70 20 CGID CC[C@@H](NC[C@@H](C)N(C)Cc1ccccc1)C1CC1 160889030 JHPLEEQHNDTLCK-RHSMWYFYSA-N 260.425 3.285 70 20 CGID CC(C)[C@@H](NC(=O)[C@@H]1OCC[C@@H]1C)c1ccc(F)cc1F 161188774 RNKSQPBXIUTMJH-COLVAYQJSA-N 297.345 3.203 70 20 CGID Cn1ccc(NC(=O)Nc2cc(-c3ccccc3)ns2)n1 161255222 PWNBZPKZRYGQRH-UHFFFAOYSA-N 299.359 3.188 70 20 CGID COc1ccc(NC(=O)CCO[C@@H](C)CC(C)C)cc1N 161353321 AGFAWCZTKSXXFN-LBPRGKRZSA-N 294.395 3.057 70 20 CGID CCCCN(C)c1ccc(C(=O)Nc2cc(C)on2)cc1 160064851 XSDGPXLMABQZQT-UHFFFAOYSA-N 287.363 3.472 70 20 CGID CSc1cccc(N(C)C(=O)c2ccnn2C(C)C)c1 160403989 JQKJNDCURQTIIO-UHFFFAOYSA-N 289.404 3.463 70 20 CGID CCc1nsc(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160679342 CIOAMJANJBGFFQ-OLZOCXBDSA-N 289.404 3.433 70 20 CGID CCC(C)(C)NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 160913831 ROZJKXQXPMACJY-CABCVRRESA-N 290.407 3.395 70 20 CGID Cc1cc(NC(=O)Cc2ccc3ccccc3c2)c[nH]c1=O 159603530 NQVONDBVECURJM-UHFFFAOYSA-N 292.338 3.018 70 20 CGID CCOc1ccccc1N(C)Cc1cc(C(=O)OC)co1 159418879 QUAWZGHPLAXVRH-UHFFFAOYSA-N 289.331 3.101 70 20 CGID CO[C@H](CNC(=O)CCc1ccc(F)cc1F)C(C)(C)C 159500122 LRSSTNJEGHGZMF-CQSZACIVSA-N 299.361 3.075 70 20 CGID C[C@H]1CCCC[C@H]1NC(=O)c1ccnc(Cl)c1F 160881898 YESIMVGPCYTPRH-WCBMZHEXSA-N 270.735 3.183 70 20 CGID CCc1ncnc(N[C@@H](C)c2cccs2)c1F 217957563 FVIGUYFIMKHNEL-QMMMGPOBSA-N 251.330 3.413 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)cc1F 161039613 AKTPRSRBKBCNBO-CFVMTHIKSA-N 294.414 3.358 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 161124968 DRVOPGQVGQFJSC-HIFRSBDPSA-N 292.354 3.213 70 20 CGID O=C(c1ccco1)N1CC[C@@H](Oc2ccccc2Cl)C1 161334505 FOPQNMPBPCBUJP-LLVKDONJSA-N 291.734 3.227 70 20 CGID CCC[C@H](CC)NC(=O)c1cnn(CC(C)C)c1C 161488699 WDOBGRIEWZKELO-ZDUSSCGKSA-N 265.401 3.156 70 20 CGID C[C@@H](CC(=O)Nc1cnc(C(C)(C)C)nc1)c1ccncc1 160239004 RVDLGIKONSWSSV-LBPRGKRZSA-N 298.390 3.301 70 20 CGID CCC(CC)CNC(=O)NC(C)(C)c1nc(C)cs1 160605126 WMDPUTKYNZALEU-UHFFFAOYSA-N 283.441 3.422 70 20 CGID CCCOc1cccc(CC(=O)N[C@@H](C)c2cccnc2)c1 160669974 IGVUJKNCWKBMIV-AWEZNQCLSA-N 298.386 3.290 70 20 CGID CCCNC(=O)Nc1cnn(-c2cc(C)ccc2C)c1C 160934508 RTJNYRMLOWFMJJ-UHFFFAOYSA-N 286.379 3.329 70 20 CGID Cc1nc2c(s1)[C@H](N[C@@H]1CCCSC1)CCC2 159619554 PYIPMHCGDRCGQQ-ZYHUDNBSSA-N 268.451 3.314 70 20 CGID C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccccc23)C[C@H]1C 159677806 ZYORBJLKMBIWGJ-UONOGXRCSA-N 299.418 3.398 70 20 CGID Cc1cc(NC(=O)[C@H](C)c2ccc(Cl)s2)c[nH]c1=O 159484737 QVSQNQSYSZGAEP-MRVPVSSYSA-N 296.779 3.140 70 20 CGID COCCC1(CN[C@@H](C)c2ccccn2)CCCC1 159376192 PCHLNXRAOJRLCO-AWEZNQCLSA-N 262.397 3.329 70 20 CGID CCC[C@@H](C)CC(=O)NCc1nc2cccc(C)c2n1C 159772627 BYPPVNCPUALMPI-GFCCVEGCSA-N 287.407 3.324 70 20 CGID O=C(C1=CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 159992064 OSCAMSKSOKEDIF-HNNXBMFYSA-N 299.370 3.232 70 20 CGID CO[C@@H]1CCC[C@@H](NCc2cccc3cccnc23)C1 159435916 YVDCCJKIBQXXMM-HZPDHXFCSA-N 270.376 3.282 70 20 CGID COC(=O)c1ccnc(NCC2CCC(C)CC2)c1 217932769 DNQFPFQEXNSFQX-UHFFFAOYSA-N 262.353 3.106 70 20 CGID CC(C)NCCC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F 161043393 FCMYFEHSUUOOIN-CJNGLKHVSA-N 292.398 3.123 70 20 CGID CCOCCC1(CNC(=O)N2CCC[C@@H](CC)C2)CC1 161485628 PKCNAJLAAXCAON-CQSZACIVSA-N 282.428 3.025 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)NCc1ccc(Cl)cc1 161494203 MCHZGQQANYBBDB-PHIMTYICSA-N 266.772 3.422 70 20 CGID COc1cc(NCc2cn(C)nc2C(C)(C)C)ccc1F 160082760 CZKOZKQFTRCFHZ-UHFFFAOYSA-N 291.370 3.477 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc2c(c1)CCC2 160089548 HHLQWNXNWWXKCB-UHFFFAOYSA-N 290.407 3.096 70 20 CGID COc1cc(NCc2cccc(OC)c2OC)ccc1F 160137639 SMFSBVVBUXYONC-UHFFFAOYSA-N 291.322 3.464 70 20 CGID CC(C)CONC(=O)Nc1ccc(N(C)C)c(Cl)c1 160181270 MYNKTWOPSPAZJR-UHFFFAOYSA-N 285.775 3.115 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccccc1 160375804 WYJUUBQJUQXGSC-OAHLLOKOSA-N 273.376 3.298 70 20 CGID Cc1cc([C@@H](C)NC(=O)N(C)CC2CCOCC2)c(C)o1 160443786 LMMYCOXJMOFMER-GFCCVEGCSA-N 294.395 3.025 70 20 CGID CCCN(Cc1ccccc1)Cc1c[nH]c(C(=O)OC)c1 160479481 DVUQJPWDTYXTNZ-UHFFFAOYSA-N 286.375 3.214 70 20 CGID CC[C@H](NC(=O)[C@@H]1C[C@@]1(C)CC)c1c(C)noc1C 160777019 WHIRBHJGVBVWNQ-SLEUVZQESA-N 264.369 3.295 70 20 CGID C[C@H](N[C@@H](C)c1ccoc1)C(=O)N1c2ccccc2C[C@H]1C 160826813 YFGDYERMCBJCFY-RDBSUJKOSA-N 298.386 3.297 70 20 CGID CCCCn1ncc(NC(=O)N2CCC(C)CC2)c1C 159638718 IRQLDWFDSAWONJ-UHFFFAOYSA-N 278.400 3.255 70 20 CGID CC[C@H](C)OCC(=O)N1CCC[C@H]1c1cccc(F)c1 159871649 CJPSMKCBSGGLKX-WFASDCNBSA-N 279.355 3.304 70 20 CGID CCCn1nccc1CNc1ccc2c(c1)OCCCO2 159957491 PEYDMSVIFZQBKT-UHFFFAOYSA-N 287.363 3.067 70 20 CGID CCC1(C(=O)NCCc2cc3ccccc3[nH]2)CCC1 159562510 ORTWXVRXODAGFQ-UHFFFAOYSA-N 270.376 3.407 70 20 CGID CC(C)C(=O)NCCCN[C@@H](C)c1ccc(Cl)cc1 159974207 DKPOURPYFGFPOI-LBPRGKRZSA-N 282.815 3.153 70 20 CGID CCOC(=O)[C@@H]1CCCCN1Cc1cnc(C(C)C)s1 161248864 VZPWLRIAUXFKMJ-ZDUSSCGKSA-N 296.436 3.184 70 20 CGID O=S(=O)(Cl)[C@@H](c1ccccc1)c1ccc(F)cc1 88251662 RBHPDLUIEMMQRT-ZDUSSCGKSA-N 284.739 3.484 70 20 CGID C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)[C@H]1CC=CCC1 161204916 DKAJFFSQYOHQSZ-JSGCOSHPSA-N 289.350 3.260 70 20 CGID CC(C)[C@H]1CCc2ccccc2N1C(=O)[C@@H]1CCCO1 161208528 UKPQKUJSYIFBGJ-ZBFHGGJFSA-N 273.376 3.169 70 20 CGID CCCn1nc(C)c(C(=O)NC2CCC(C)CC2)c1C 161337890 IQEFDUPXAPISCQ-UHFFFAOYSA-N 277.412 3.218 70 20 CGID CC(C)C[C@H](C)NC(=O)N1CCc2cccc(F)c2C1 160203068 AKUDQQDBYINXLQ-LBPRGKRZSA-N 278.371 3.328 70 20 CGID CCc1c(Cl)nc(C)nc1N[C@H]1CCO[C@@H](C2CC2)C1 160384574 BCZUARCUSNCIBQ-WCQYABFASA-N 295.814 3.370 70 20 CGID CCOCCC1(CNC(=O)N[C@@H](C)CC2CC2)CCCC1 160407099 ACRAYUNTXMVANX-AWEZNQCLSA-N 296.455 3.461 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCC[C@@H](C)C1 160515239 VWZZMZRPSPPQAZ-GFCCVEGCSA-N 263.385 3.116 70 20 CGID O=C(NCC1(C2CC2)CCC1)N[C@H]1[C@@H]2c3ccccc3C[C@H]21 160581660 HHRNTCPUAMHIHX-BRWVUGGUSA-N 296.414 3.204 70 20 CGID Cc1cccc(NC(=O)c2cc(F)cc3cccnc23)n1 160747539 DCGVNWYVSNFODS-UHFFFAOYSA-N 281.290 3.330 70 20 CGID CCNC(=O)N1CCCCC[C@@H]1c1ccc(CC)o1 160805173 WMQHAPHJIWDIPS-CYBMUJFWSA-N 264.369 3.489 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 160811745 QRARFCNXRVBEOW-KANYHAFZSA-N 275.348 3.029 70 20 CGID c1coc([C@H]2CCCCCN2CCn2ccnc2)c1 159836935 QWYOGCGNXHHIQQ-CQSZACIVSA-N 259.353 3.093 70 20 CGID CCc1noc(C)c1CSC[C@H]1CCCCO1 159676271 GOVIWSSBCOEDEJ-LLVKDONJSA-N 255.383 3.348 70 20 CGID Cc1ccccc1[C@@H](CC(C)C)NC(=O)[C@H](N)C(C)C 159694618 VDQSLSZIXTUOHB-HZPDHXFCSA-N 276.424 3.182 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N1CCC[C@@H]1Cc1ccccc1 159547296 WZJJXVGYRKNEHF-YXJHDRRASA-N 299.414 3.225 70 20 CGID CCOC(=O)CC1CCN(C(=O)[C@H]2CCC[C@@H](C)C2)CC1 159984980 SXRKIEQLVKMQME-HIFRSBDPSA-N 295.423 3.005 70 20 CGID CS[C@H]1CC[C@H](Nc2ccc(C(F)(F)F)nn2)C1 218045410 LVFFQXGGAPDVAH-YUMQZZPRSA-N 277.315 3.191 70 20 CGID CCOc1ccc(CNC(=O)N[C@H]2CCCC[C@@H]2C)cc1 217300898 RJVYGKNJHYHWQK-BBRMVZONSA-N 290.407 3.463 70 20 CGID CCCCCC[C@@H](C)OS(=O)(=O)C(F)(F)F 166272768 YUWDHKADIYFVQQ-MRVPVSSYSA-N 262.293 3.212 70 20 CGID CC[C@H](C)[C@H](C)N(C(=O)NCC1(CCOC)CC1)C1CC1 161147751 OTYQMACHWQJJRG-KBPBESRZSA-N 296.455 3.412 70 20 CGID CC(C)C[C@H](C)NC(=O)Nc1ccccc1-n1cccn1 160164242 GLSSBTRRDTWMNB-ZDUSSCGKSA-N 286.379 3.428 70 20 CGID C[C@H](CC(=O)NCCCOC1CCCC1)c1ccncc1 160279633 QFQIOLSYYAUEDL-CQSZACIVSA-N 290.407 3.041 70 20 CGID CSC[C@@H](CCO)N[C@@H](CCc1ccccc1)C(C)C 160351009 AORYMRAEGVOEQO-SJORKVTESA-N 295.492 3.347 70 20 CGID CC(C)CSCCCNC(=O)C[C@H](C)c1ccncc1 160690565 UXWRNGKJOQSWAW-AWEZNQCLSA-N 294.464 3.471 70 20 CGID CC(C)c1cc(-c2nc(Cc3ccccc3)no2)no1 160804671 HELOGGKSUNKPGM-UHFFFAOYSA-N 269.304 3.439 70 20 CGID Cc1noc(Cl)c1CC(=O)N1CCC[C@@H]1C1CCCC1 160793514 NDCLASOZQLIEJZ-CYBMUJFWSA-N 296.798 3.360 70 20 CGID COc1ccccc1-c1noc([C@@H]2CCC(=O)C[C@H]2C)n1 160990759 NOWJSKQLILVKET-ZYHUDNBSSA-N 286.331 3.218 70 20 CGID CC[C@H](NCCOC[C@@H]1CCCO1)c1ccc(F)cc1F 160931095 LOFGHUJZBDEBGO-BBRMVZONSA-N 299.361 3.201 70 20 CGID CCc1ccc(NC(=O)N[C@H](CC)[C@@H]2CCCO2)cc1 159409857 VHIJLEWGQVLHOS-CABCVRRESA-N 276.380 3.328 70 20 CGID CC(=O)NC1CCC(N[C@H](C)c2ccccc2C)CC1 159410995 ALURNYAILJYZSQ-IUDNXUCKSA-N 274.408 3.093 70 20 CGID Cc1ccccc1[C@H](NC(=O)[C@H](C)N)[C@H]1CCC[C@H](C)C1 159686657 FOTRFUYDDSBBKO-NZUILWFCSA-N 288.435 3.326 70 20 CGID CCC[C@@H](C)C(=O)N(C)c1ccc(OC)c(F)c1 159737704 MZFGRWUTBZJCMB-SNVBAGLBSA-N 253.317 3.233 70 20 CGID CCOc1ccc([C@H](C)N[C@H](COC)C(C)C)cc1OC 159970503 LKIGMUXSXJRFAQ-DZGCQCFKSA-N 295.423 3.416 70 20 CGID CCOc1ccc([C@H](C)N[C@@H](COC)C2CC2)cc1OC 159978781 CFSKSFKGYVVIQV-WFASDCNBSA-N 293.407 3.170 70 20 CGID CCCN(C)[C@@H](C)c1nc(Cc2ccccc2)no1 159780178 FBZPEYBYAQSKSF-LBPRGKRZSA-N 259.353 3.063 70 20 CGID CCOc1ccc(NCc2c(C)n[nH]c2C)cc1F 159740198 SYGCINPLZDSIRV-UHFFFAOYSA-N 263.316 3.176 70 20 CGID O=S(=O)(Cl)[C@@H]1CCCC[C@H]1c1ccccc1 88251587 RJCAPJKKRJGVKO-NWDGAFQWSA-N 258.770 3.281 70 20 CGID CCCCCOC[C@@H](CS(=O)(=O)Cl)C(C)C 114477015 ISFDCJDYZQSTSQ-NSHDSACASA-N 270.822 3.034 70 20 CGID CCc1ccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)cc1 161016710 XJNNLSWYJVKYIY-JKSUJKDBSA-N 288.391 3.328 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@@H](C)CC1CCCCC1 161157090 QMONLDUPIZFYCW-ZFWWWQNUSA-N 269.429 3.116 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)C(C)(C)Oc1ccc(F)cc1 161467549 XMFYWQQNHRHZME-VXGBXAGGSA-N 279.355 3.383 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccc2c(c1)CCCC2 160160603 GXYJTTVPLRQIRH-GUYCJALGSA-N 287.403 3.312 70 20 CGID COc1ccc(N(C)C(=O)C2CC=CC2)cc1Cl 160207198 WAAWDJMDNZPWQI-UHFFFAOYSA-N 265.740 3.278 70 20 CGID COc1cccc(C2(C(=O)NC3CC=CC3)CCCC2)c1 160843902 BDTCMCIEODSZHU-UHFFFAOYSA-N 285.387 3.342 70 20 CGID CCCn1c(C)nnc1CN1[C@H]2CCCC[C@@H]2C[C@H]1C 159682367 GADACZKJBZBNEM-YUELXQCFSA-N 276.428 3.150 70 20 CGID O=C(Cc1c(F)cccc1Cl)NCC1(C2CC2)CC1 159733934 MEDQVPUHYIRMPB-UHFFFAOYSA-N 281.758 3.328 70 20 CGID Cc1ccccc1[C@@H](C)N[C@@H]1CCN(c2ncccc2F)C1 159788077 TVZZMDCWINJTOY-HUUCEWRRSA-N 299.393 3.459 70 20 CGID CC(C)(C)C1=CCN(S(=O)(=O)c2ccccc2F)CC1 160772036 WOMBXRJPEMJDLB-UHFFFAOYSA-N 297.395 3.193 70 20 CGID COc1cccc(Cl)c1CNC1C[C@@H](C)O[C@H](C)C1 218146175 LVHPOPCOFRUBAK-GHMZBOCLSA-N 283.799 3.394 70 20 CGID O=C(Nc1ccc(F)c(F)c1)N[C@@H]1CCO[C@H](C2CC2)C1 161002404 KPVOFNKQPPVLBL-RISCZKNCSA-N 296.317 3.044 70 20 CGID O=C(/C=C/c1ccco1)N[C@@H]1CCOC2(CCCCC2)C1 161473231 JPWFZJRYMSNMQE-PSKZRQQASA-N 289.375 3.291 70 20 CGID CC(C)(C)CCCC(=O)NCCCC(C)(C)CO 160375770 FPULRNVBEMYJGU-UHFFFAOYSA-N 257.418 3.118 70 20 CGID CC(C)C[C@@H](C)NC(=O)NCCc1ccc(Cl)nc1 160381140 NYOAKYHMEWGWFX-LLVKDONJSA-N 283.803 3.011 70 20 CGID CCCc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1 160422043 HLWCDFBZXVHGLH-DYVFJYSZSA-N 298.434 3.205 70 20 CGID CCCCN(C)C(=O)[C@H]1C[C@@H]1c1sccc1C 160593251 RVQYIAQYMGXFCF-RYUDHWBXSA-N 251.395 3.419 70 20 CGID CC[C@H](NCCOc1ccc(Cl)cc1)[C@@H]1CCOC1 159640466 ICGRTQACGUZEDM-DOMZBBRYSA-N 283.799 3.124 70 20 CGID CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc(F)c(OC)c1 159702690 YWRGQADRBUCOKF-GXTWGEPZSA-N 297.395 3.238 70 20 CGID CCCn1nccc1CNc1ccc2ncccc2c1 160136892 BXCIHVCNISTADH-UHFFFAOYSA-N 266.348 3.453 70 20 CGID O=C(/C=C\c1cc(Cl)cc(Cl)c1)NCc1ncc[nH]1 217008673 GKWBCBYMDDWSPK-UPHRSURJSA-N 296.157 3.046 70 20 CGID C[C@H](CC(=O)N[C@@H]1C[C@@H]1C1CCCCC1)[C@@H]1CCCNC1 161067077 PFNNZMHWLMTHKK-MWQQHZPXSA-N 292.467 3.097 70 20 CGID CCC(CC)(CN)C(=O)N[C@@H]1CCC[C@H](C(C)C)C1 161213559 ZGTPINZJQOUBGT-UONOGXRCSA-N 268.445 3.083 70 20 CGID CC(C)Oc1cncc(C(=O)Nc2ncc(Cl)s2)c1 161241519 PPMUAVAKXDGJSJ-UHFFFAOYSA-N 297.767 3.231 70 20 CGID CCC[C@H](N[C@@H](CCO)CSC)c1ccccc1 160148296 RYUSPLYNNVEROO-GJZGRUSLSA-N 267.438 3.231 70 20 CGID C[C@H]1CCN(C(N)=O)[C@@H]1c1ccc(C(F)(F)F)cc1 160949521 WQOCEFBAFYJSPW-KWQFWETISA-N 272.270 3.167 70 20 CGID CC(C)N(CCCS(=O)(=O)C(C)C)c1ccccc1 160973006 AUPWKSDFYMJRQH-UHFFFAOYSA-N 283.437 3.115 70 20 CGID Cc1[nH]ccc1C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 159456341 KHBXRVWSGAKNGK-RHSMWYFYSA-N 298.386 3.221 70 20 CGID CC[C@H]1CCCCN1C(=O)[C@H](C)Sc1ccncc1 159870285 XVZCOOPIQBQANI-STQMWFEESA-N 278.421 3.353 70 20 CGID O=C(CSc1ccccc1)NCC1(C2CC2)CC1 159760824 OZOIEXXCVRJRHR-UHFFFAOYSA-N 261.390 3.085 70 20 CGID Cn1cc([C@H]2CCCN2C(=O)C2CCC(C)(C)CC2)cn1 159995608 QBQLFJBQCBTFEY-OAHLLOKOSA-N 289.423 3.300 70 20 CGID CC1(C)CC[C@H](COC(=O)c2cc(Cl)ccc2N)O1 160779755 KCUHHOFCTPTHRH-SNVBAGLBSA-N 283.755 3.037 70 20 CGID CC(C)C(=O)Nc1ccc(OCc2nccs2)cc1 161405189 DFRJXPOJYUHIKL-UHFFFAOYSA-N 276.361 3.317 70 20 CGID C[C@@H](NC[C@@H]1CCc2ccccc21)C1CCN(C)CC1 161006478 NLCMNHKDHRLWLF-PBHICJAKSA-N 272.436 3.036 70 20 CGID CC[C@@H](COC)N[C@H](c1ccc2c(c1)OCCO2)C(C)C 161040242 BAZSQRFZQCCWPT-YOEHRIQHSA-N 293.407 3.170 70 20 CGID CS[C@H](C)CC(=O)N[C@@H]1CCCc2sccc21 160201250 JJJPNBOEWVRGQI-MWLCHTKSSA-N 269.435 3.383 70 20 CGID C[C@H](C(=O)N[C@H]1CCc2c(O)cccc21)c1cccs1 160234741 SGFGLJPMHWHCAQ-GWCFXTLKSA-N 287.384 3.361 70 20 CGID CC(C)CCN(C(=O)N[C@H]1CCO[C@H](C2CC2)C1)C1CC1 160292829 SNOYSEIHOHPGNK-HOCLYGCPSA-N 294.439 3.164 70 20 CGID CCc1nc(C)c([C@@H](C)NC[C@H]2CCCC[C@@H]2O)s1 160462559 XWGLBMQWZJFZOP-RTXFEEFZSA-N 282.453 3.216 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)N[C@H]3C[C@H]3C)c2C)c1 160744225 QCRHTKGZYQWZBN-OCCSQVGLSA-N 298.390 3.327 70 20 CGID CCCCO[C@@H]1C[C@@H](N[C@@H](C)C2CCN(C)CC2)C1(C)C 159804446 UDTVEACKGHSMBD-USXIJHARSA-N 296.499 3.290 70 20 CGID COc1ncccc1NC(=O)[C@@H](c1ccccc1)C1CC1 159672521 BBVCACAIGDPXBG-HNNXBMFYSA-N 282.343 3.223 70 20 CGID COc1csc(C(=O)N(C)c2ccc(OC)c(F)c2)c1 159593365 ZXIGPPLKRRVQMC-UHFFFAOYSA-N 295.335 3.181 70 20 CGID OCc1ccccc1NCc1cccc2c1NCCC2 159365352 ZOYDZDKXUHUTPW-UHFFFAOYSA-N 268.360 3.149 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(Cl)ccn1 159578486 GNPWZHJBNOSOMV-MWLCHTKSSA-N 252.745 3.044 70 20 CGID O=C(Cc1c[nH]c2ccccc12)NCC1(C2CC2)CC1 160081875 MEIKPNCNLAEDMJ-UHFFFAOYSA-N 268.360 3.017 70 20 CGID Cc1c(CNCc2csc3ccccc23)cnn1C 160220043 SXEAZAGFQDVBLD-UHFFFAOYSA-N 271.389 3.233 70 20 CGID COC(=O)C1(NCc2ccc(Cl)cc2)CCCCC1 217097192 VLHPCZDINHGAJA-UHFFFAOYSA-N 281.783 3.306 70 20 CGID COc1ccccc1NC(=O)c1cccc(C)c1F 161386779 NKCHWDITIUXHER-UHFFFAOYSA-N 259.280 3.395 70 20 CGID c1ccc2sc([C@@H]3CCCN3Cc3cc[nH]n3)nc2c1 160721631 QPHSBBRWXGHKAX-ZDUSSCGKSA-N 284.388 3.357 70 20 CGID CO[C@@H]1CCCC[C@@H]1N[C@@H](C)c1ccc2c(c1)OCO2 218097059 MKNSOIZANVVJNF-FPMFFAJLSA-N 277.364 3.024 70 20 CGID CC1CCC(CNC(=O)NCc2ccccc2)CC1 218048965 WICHXJUCVQXWMK-UHFFFAOYSA-N 260.381 3.312 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)cc1F 161022952 LLJCXDISAOAFLS-UKRRQHHQSA-N 292.354 3.213 70 20 CGID C[C@@H](NC[C@](C)(O)c1ccsc1)C1CCCC1 160099580 VZTIHESBASRMNR-RISCZKNCSA-N 253.411 3.124 70 20 CGID CCCC1(CNC(=O)c2ccccc2COC)CC1 160671846 QIQMSEGAUWJLOT-UHFFFAOYSA-N 261.365 3.143 70 20 CGID CCCCOCC(=O)N[C@@H]1CCCc2sccc21 159909461 GUXSDBISRRIRMG-GFCCVEGCSA-N 267.394 3.058 70 20 CGID Cc1cc(F)cc(NC(=O)N[C@H](CO)CC(C)(C)C)c1 159511031 PXXMNVIQCZSRJO-ZDUSSCGKSA-N 282.359 3.053 70 20 CGID C1=C(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)COc2ccccc21 159558693 BEZYUXJZLKTFCM-NXHRZFHOSA-N 297.398 3.010 70 20 CGID C[C@H]1CCC[C@H](CNC(=O)NCc2ccccc2)C1 218047797 DJJQJBKFYGCRFX-ZFWWWQNUSA-N 260.381 3.312 70 20 CGID CC(C)[C@H](CNCC1(O)CCCC1)c1ccccc1 218211129 TYTFCKNONHHHPE-INIZCTEOSA-N 261.409 3.321 70 20 CGID N[C@H]1CCCCCC[C@@H]1C(=O)N1CCC2(CCCCC2)C1 161196871 WZRVWNDVFHEKGV-HOTGVXAUSA-N 292.467 3.467 70 20 CGID C[C@H]1CCN(C(=O)NCc2cc3ccccc3[nH]2)C[C@@H]1C 161292732 YPMZJVXTBYGYPY-STQMWFEESA-N 285.391 3.355 70 20 CGID CC1(NC(=O)c2cc(F)cc3cccnc23)CCC1 161310148 XHHBMDJQWSSRQI-UHFFFAOYSA-N 258.296 3.046 70 20 CGID CC[C@H](C(=O)Nc1ccc(Oc2ccccc2)nc1)N(C)C 161333443 DMVMPWUSUMGRMA-OAHLLOKOSA-N 299.374 3.153 70 20 CGID Cc1cc(Cl)ccc1OCC(=O)N1[C@H](C)CC[C@H]1C 161402211 GHAQFNLUEOUNJO-VXGBXAGGSA-N 281.783 3.427 70 20 CGID CC[C@H](c1ccccc1)S(=O)(=O)[C@@H](C)c1nnc(C)o1 160433142 IMHSIKXCIIEOQC-GXFFZTMASA-N 294.376 3.005 70 20 CGID CC[C@H](C(=O)N[C@H]1CCCSC1)c1ccc(F)cc1 160774441 VZZXJBLAYOTHTD-KBPBESRZSA-N 281.396 3.331 70 20 CGID CCCCS[C@H](C)C(=O)NCC1(C2CC2)CC1 159802472 VCYBMHFDCITCGF-LLVKDONJSA-N 255.427 3.215 70 20 CGID CCC(C)(CC)C(=O)N1CCC[C@H](C(C)(C)C(=O)OC)C1 159421175 XHQBRORODWRTTA-ZDUSSCGKSA-N 297.439 3.251 70 20 CGID CC(C)CCO[C@@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159884496 OHGOJOPEODSVEI-GFCCVEGCSA-N 297.468 3.477 70 20 CGID CC(C)CC1(CNC(=O)NC2C[C@H](C)O[C@@H](C)C2)CC1 159909161 SZUGGLWLGUZESQ-STQMWFEESA-N 282.428 3.068 70 20 CGID CC(C)CC(C)(C)CNC(=O)NCc1ncccc1F 159515474 VYIBLFNMYVFINR-UHFFFAOYSA-N 281.375 3.092 70 20 CGID C[C@@H](NC(=O)Nc1ccc(F)c(F)c1F)C1CCC1 159362635 ONTFSPALAJSSEM-SSDOTTSWSA-N 272.270 3.414 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1Cc2ccccc2O1 159958021 DICUEQOGWOHDTB-HIFRSBDPSA-N 299.395 3.245 70 20 CGID CC[C@H]1CN(C(=O)[C@@H](C)Cc2ccccc2F)C[C@H](C)O1 159781400 IYPAMVJAGORJSR-YDHLFZDLSA-N 293.382 3.030 70 20 CGID O=C(/C=C/c1ccccc1)N(CCCO)Cc1ccccc1 218748511 TZKIMSGMRPDGDC-OUKQBFOZSA-N 295.382 3.111 70 20 CGID O=C(Nc1ccccc1O)C1C2CC3CC(C2)CC1C3 217807715 ZZDWXXLRFYJADP-UHFFFAOYSA-N 271.360 3.403 70 20 CGID C[C@H]1CC/C(=C/C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 776368140 OHMOCSZYZDGJIM-RGAIUGGKSA-N 297.351 3.030 70 20 CGID Cc1cc(C)cc(NC(=O)NCCCC(=O)OC(C)C)c1 161011467 PVALHXVVZFFJEX-UHFFFAOYSA-N 292.379 3.157 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 161014686 LWIMUMAJCGDKNN-UKRRQHHQSA-N 292.354 3.213 70 20 CGID CCCn1nccc1CNc1cccc(-n2ccnc2)c1 160011691 JZFKKQVFUPEUNV-UHFFFAOYSA-N 281.363 3.091 70 20 CGID CC[C@H](SCCN1CCOCC1)c1ccc(F)cc1 160034369 PICZZHCCJBLRNJ-HNNXBMFYSA-N 283.412 3.342 70 20 CGID CC(C)(C)CC(C)(C)NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 160280809 JJBOVQSPLZQHCY-KBPBESRZSA-N 296.455 3.458 70 20 CGID Cc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)c(C)c1 160428193 ASQZKNIZPJSHCV-UHFFFAOYSA-N 283.327 3.309 70 20 CGID COc1ccccc1[C@H]1CCN(C(=O)OC(C)(C)C)C1 160517458 IXHHRMWJGKRNHR-LBPRGKRZSA-N 277.364 3.420 70 20 CGID Cc1cc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c[nH]c1=O 159397486 MMFVCOJBNQYFJQ-MGPQQGTHSA-N 288.391 3.228 70 20 CGID Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)s1 159623404 GQVJJKYAFWSDKV-MCIONIFRSA-N 263.406 3.104 70 20 CGID CC(C)OCCNC(=O)c1cc(Cl)c2ccccc2n1 160173712 QSZNESGCSXSSHZ-UHFFFAOYSA-N 292.766 3.043 70 20 CGID OC[C@@H](Cc1ccccc1)NCc1ccc(Cl)cc1F 160822014 XYTAKEJXCWESBR-OAHLLOKOSA-N 293.769 3.172 70 20 CGID C[C@@H](CCC(C)(C)C)NC(=O)c1ccc(CN)cc1 161230043 DNJXFLRFAQHLOB-LBPRGKRZSA-N 262.397 3.090 70 20 CGID C[C@]1(c2ccccc2)CC(=O)N(CC2CCCCC2)C1=O 217132367 ZFEFASPOZLXRIT-GOSISDBHSA-N 285.387 3.284 70 20 CGID CCCC(C)(C)NC(=O)Cc1cc(F)c(F)cc1F 159611467 JVPGPDMDGUKSPD-UHFFFAOYSA-N 273.298 3.341 70 20 CGID COC(=O)c1ccc(CSCCOCC2CC2)s1 159810849 RDCSAFJRUIMYER-UHFFFAOYSA-N 286.418 3.195 70 20 CGID Cc1nc2c(n1CC(=O)c1ccccc1F)CCCC2 216880296 UVOLZWRBNVBSJY-UHFFFAOYSA-N 272.323 3.092 70 20 CGID Cc1c(NC(=O)N2CC[C@@H](C)[C@H]2C)cnn1CCC(C)C 161315805 QTSRJMGNLIRLDQ-CHWSQXEVSA-N 292.427 3.500 70 20 CGID O=C(Nc1cccc(OCc2nccs2)c1)C1CC1 161353419 TZTKKGOTVDSSER-UHFFFAOYSA-N 274.345 3.071 70 20 CGID CC[C@H](C)c1cc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)on1 160312697 CYRHQZALESESOP-SMDDNHRTSA-N 287.363 3.494 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1cccnc1Cl 160599764 VCYLUQRVWHMGJP-RYUDHWBXSA-N 297.830 3.430 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cc(C)no1 160780667 PQXFVVSYHRYLKL-RYUDHWBXSA-N 250.342 3.024 70 20 CGID CC(C)CCn1ccc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)n1 159674915 NWBZMNLOUIPOLV-KBPBESRZSA-N 290.411 3.193 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc2cc[nH]c2c1 159547365 KJDDPRZPVVSPCJ-HNNXBMFYSA-N 298.386 3.390 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc2cc[nH]c2c1 160149260 YDUJTGVIKLZDQK-UHFFFAOYSA-N 254.333 3.088 70 20 CGID CCCN(Cc1ccccc1)Cc1cn(C)nc1C 160474707 PAMNQROIPZLXBU-UHFFFAOYSA-N 257.381 3.141 70 20 CGID O=C(NCCc1ccccc1)Nc1cc(Cl)ccn1 217304846 XEPKJSUAFOYYMY-UHFFFAOYSA-N 275.739 3.099 70 20 CGID COC(=O)c1ccnc(NC[C@@H]2CCC[C@@H](C)C2)c1 217929173 UVYJNYUUWBAEKH-VXGBXAGGSA-N 262.353 3.106 70 20 CGID CC(C)OC(=O)c1ccn(C/C=C/c2ccccc2)c(=O)c1 161056384 SXCIXUOXCJFYEJ-RMKNXTFCSA-N 297.354 3.127 70 20 CGID COc1ccc(NC(=O)N[C@@H](C)C2CCC2)cc1F 161129535 NPWFOQGRPHRYNF-VIFPVBQESA-N 266.316 3.144 70 20 CGID Cc1cc(NC(=O)[C@@H](C)Cc2ccccc2Cl)nn1C 161176499 GQURIARJQBQDIN-JTQLQIEISA-N 291.782 3.199 70 20 CGID C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)C[C@@H]1C=CCC1 161245028 LMCLRFMXRUNUAH-QWHCGFSZSA-N 289.350 3.260 70 20 CGID Cc1ccc(C)c(OCCC(=O)NCC2(C3CC3)CC2)c1 160157433 UBIKBYNWPHIWAF-UHFFFAOYSA-N 287.403 3.379 70 20 CGID O=C(NCCc1ccco1)c1cc(F)c(Cl)cc1F 160556280 XKLOAAQRCWNSLE-UHFFFAOYSA-N 285.677 3.184 70 20 CGID CC1(C)C[C@H](NCc2ccc(OCC(F)F)cc2)CCO1 160545949 SZPNNLIVNCVQSQ-CYBMUJFWSA-N 299.361 3.378 70 20 CGID CC1(C)C[C@H](NCc2cc(F)cc3cccnc23)CCO1 160561046 UPRKJHUAHCKIIR-OAHLLOKOSA-N 288.366 3.421 70 20 CGID CC1(C)C[C@H](NCc2ccc3c(c2)CC(C)(C)O3)CCO1 160632977 FDXWRKKZULRYNZ-OAHLLOKOSA-N 289.419 3.447 70 20 CGID CC1(C)C[C@@H](NCc2ccc3c(c2)CC(C)(C)O3)CCO1 160633107 FDXWRKKZULRYNZ-HNNXBMFYSA-N 289.419 3.447 70 20 CGID CCc1ccc([C@H](C)NC[C@H]2CCCC[C@@H]2O)o1 160656856 PFAUQXISEAEVDM-SCRDCRAPSA-N 251.370 3.044 70 20 CGID Cc1ccc(C)c(-n2ncc(C(=O)N(C)C(C)C)c2C)c1 160671317 BUFWXULSDHNAER-UHFFFAOYSA-N 285.391 3.278 70 20 CGID CC(C)[C@H](NC(=O)[C@@H]1CCCNC1)c1ccccc1Cl 160830508 YSVKFKOYRANXON-DOMZBBRYSA-N 294.826 3.153 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCCC[C@H]1C 160934032 KOBLRMJGYSNYMM-GFCCVEGCSA-N 263.385 3.259 70 20 CGID c1ccc([C@H](NCCOCC2CC2)c2nccs2)cc1 159821914 VARXBBJZMRAYFX-HNNXBMFYSA-N 288.416 3.249 70 20 CGID COCc1nc(C)c(C(=O)N(C2CC2)[C@H](C)C(C)C)s1 159719994 ZGARBUGNSDVWII-LLVKDONJSA-N 296.436 3.247 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)N1CCC[C@@H]1Cc1ccccc1 159547166 WZJJXVGYRKNEHF-QGPMSJSTSA-N 299.414 3.225 70 20 CGID Cc1cccc(CNC(=O)NC[C@@]2(C)CCCS2)c1 159976150 OMVGGBDBNONAMZ-OAHLLOKOSA-N 278.421 3.080 70 20 CGID CN(C)[C@H]1CCC[C@@H](Nc2nc(C(C)(C)C)ns2)C1 159841965 LHCVIWDVQPDUCX-MNOVXSKESA-N 282.457 3.120 70 20 CGID Cc1cc(C(=O)N2CC=C(C(F)(F)F)CC2)ccc1F 160573839 DBBRQHFDRGVMRO-UHFFFAOYSA-N 287.256 3.469 70 20 CGID CC(C)(C)C[C@H](CO)Nc1nnc(C(C)(C)C)s1 161440137 YTVGVCAUIAJXOS-SECBINFHSA-N 271.430 3.045 70 20 CGID Cc1ccccc1OCCCNC(=O)N1CCC[C@@H](C)C1 217300379 SUHRIUZASQAACE-CQSZACIVSA-N 290.407 3.205 70 20 CGID C[C@@H]1CC/C(=C/C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 776368139 OHMOCSZYZDGJIM-QLWWJYNRSA-N 297.351 3.030 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1ccc(C)c(C)c1 161038673 NZGGRFPHWKXSLK-IBGZPJMESA-N 277.389 3.470 70 20 CGID CC[C@@H](C)NC(=O)c1cccc(CN[C@@H](C)C(C)C)c1 161067022 NFFNWOZCWADXCV-KGLIPLIRSA-N 276.424 3.349 70 20 CGID Cn1ncc2c1CCC[C@@H]2NCc1coc2ccccc12 161081848 HJYPRNBVNGHDQT-HNNXBMFYSA-N 281.359 3.334 70 20 CGID C/C(=C/c1cccc(O)c1)c1nc2sccc2c(=O)[nH]1 161470202 CTGVQKTYSHYAQN-CLFYSBASSA-N 284.340 3.251 70 20 CGID CCCn1c(C)nnc1CN1C[C@H](C)[C@@H]1c1ccccc1 160664615 CXNFHVFRTVKPOJ-SUMWQHHRSA-N 284.407 3.190 70 20 CGID C[C@]1(CNC(=O)N[C@@H]2CCCc3occc32)CCCS1 160672435 NQIHOBQOMLUPLD-IUODEOHRSA-N 294.420 3.242 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)N[C@@H]3C[C@H]3C)c2C)c1 160744118 QCRHTKGZYQWZBN-TZMCWYRMSA-N 298.390 3.327 70 20 CGID C[C@H]1C[C@@H](NCCOc2cccc3ccccc23)CCN1C 160811601 HWCOVEHGGDJEHN-RDJZCZTQSA-N 298.430 3.291 70 20 CGID CC[C@H](NCC(=O)NC1CCCC1)c1ccc(F)cc1F 160835351 KLTRCAUOJJVLSL-HNNXBMFYSA-N 296.361 3.064 70 20 CGID CCCCn1ncc(C(=O)NCc2ccc(F)cc2)c1C 159602844 OBFQIXPBSBVHQV-UHFFFAOYSA-N 289.354 3.061 70 20 CGID COc1ccc(N(C)C(=O)CC[C@@H]2CC[C@H](C)O2)cc1F 159457043 FUVGLTHSXYYGLB-AAEUAGOBSA-N 295.354 3.145 70 20 CGID C[C@H](NCCO)c1ccc(Oc2ccccc2)c(F)c1 159688208 PHIZKWMFRPHXAB-LBPRGKRZSA-N 275.323 3.261 70 20 CGID CCCN(CCC)C(=O)CCC(=O)N[C@@H]1CCC[C@H]1CC 159713490 GDQMIDVYPZPCEO-HUUCEWRRSA-N 296.455 3.110 70 20 CGID C1=C(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)COc2ccccc21 159558833 BEZYUXJZLKTFCM-NJAFHUGGSA-N 297.398 3.010 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)N(CC)CC 159963508 HJOKGFFYIIIMFY-NSHDSACASA-N 284.425 3.036 70 20 CGID C[C@H](NCCCN1CCCC1=O)c1cc2ccccc2o1 159576932 WOUHYGCKRMHTRR-ZDUSSCGKSA-N 286.375 3.096 70 20 CGID COc1ccc2c(c1)[C@@H](N[C@H]1CCOC(C)(C)C1)CC2 159926741 XFNHYXJLUSFEMZ-BBRMVZONSA-N 275.392 3.230 70 20 CGID Cc1ccccc1C1CC(NCC2(CO)CCCC2)C1 160066293 FYVVDXKGEYFQKR-UHFFFAOYSA-N 273.420 3.383 70 20 CGID CCN1CCC(CNCc2coc3ccccc23)CC1 161098118 XTSQEVFHFDBJPK-UHFFFAOYSA-N 272.392 3.254 70 20 CGID Clc1ccc2nc(SCn3cccn3)[nH]c2c1 218281774 KNDDZBJDTISJFB-UHFFFAOYSA-N 264.741 3.163 70 20 CGID C[C@H]1C[C@@H](C)CN(C[C@@H](O)c2cc3ccccc3o2)C1 216871229 YPEIIRPPCKKFLJ-VNHYZAJKSA-N 273.376 3.444 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 161014482 LWIMUMAJCGDKNN-HIFRSBDPSA-N 292.354 3.213 70 20 CGID Cc1cccc(C)c1NC(=O)N(C)CCc1nccs1 160032968 ZOOCSNDQTXMSSU-UHFFFAOYSA-N 289.404 3.466 70 20 CGID CCCOCc1ccccc1CNC(=O)C[C@@H](C)SC 160143361 ARSVUHLURYWDCL-CYBMUJFWSA-N 295.448 3.371 70 20 CGID COCCC1(C(=O)N[C@@H]2CCc3ccccc32)CCCC1 160261721 HAUUGEXHKCQFAJ-MRXNPFEDSA-N 287.403 3.387 70 20 CGID CS[C@@H](C)CC(=O)N[C@H](C)Cc1ccccc1C 160324835 ONRAXUINGGBWJV-OLZOCXBDSA-N 265.422 3.184 70 20 CGID COCCC1(CNC(=O)N[C@@H](C)CC2CC2)CCCC1 160409719 WRJZWWIACSOSPL-ZDUSSCGKSA-N 282.428 3.071 70 20 CGID CC(C)c1nccc(N2CCC[C@H]2CN2CCCCC2)n1 160435631 IJUPUHPRYCFCPM-HNNXBMFYSA-N 288.439 3.055 70 20 CGID CCC(CC)n1nccc1C(=O)N[C@@H](C)c1ccccn1 160589181 LBYYNSUUWASKLU-LBPRGKRZSA-N 286.379 3.130 70 20 CGID CC[C@@H](C(=O)N[C@H]1CCCSC1)c1ccc(F)cc1 160774569 VZZXJBLAYOTHTD-UONOGXRCSA-N 281.396 3.331 70 20 CGID CN(Cc1cccn1C)C(=O)C1(c2ccccc2)CCCC1 160938186 SBEAZCHJPYZMQG-UHFFFAOYSA-N 296.414 3.496 70 20 CGID C[C@H](C(=O)OC(C)(C)C)N(C)c1nc(C(C)(C)C)ns1 159822543 IHOGWQFDFVXPIU-SECBINFHSA-N 299.440 3.002 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@H]1c1ccc(F)cc1F 159868860 OAXMTHGDHAQNBQ-KBPBESRZSA-N 291.341 3.375 70 20 CGID Cc1ccc(O)c(NC(=O)CC2CCSCC2)c1 159512778 PMRWMPCXLKQPJT-UHFFFAOYSA-N 265.378 3.172 70 20 CGID C[C@@H]1CCC[C@H](C(=O)N[C@@H]2CCOC3(CCCC3)C2)C1 159934104 DOPWHOVJFZIXHO-QLFBSQMISA-N 279.424 3.421 70 20 CGID CCc1cccc(C)c1NC(=O)NCC(CC)(CC)CO 159786598 HFAFOTPYKDBHEC-UHFFFAOYSA-N 292.423 3.478 70 20 CGID COc1ccc(CNCc2coc3ccccc23)cn1 159799805 HTVGNMKPJMXRNL-UHFFFAOYSA-N 268.316 3.126 70 20 CGID O=C(/C=C\c1cccc(F)c1)NCC1(O)CCCCCC1 218246778 STWVEZRWJRVATE-HJWRWDBZSA-N 291.366 3.040 70 20 CGID C[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 864238863 QTSXSDRHAHNZPG-QMTHXVAHSA-N 299.367 3.110 70 20 CGID CC[C@@H](S[C@H]1CCN(C)C1=O)c1ccc(F)cc1 161354673 WBFGJGNPSAWPAS-OLZOCXBDSA-N 267.369 3.241 70 20 CGID COc1ccccc1NC(=O)N1CC[C@@H]2CCCC[C@@H]21 160049092 PGFJHLBJGNXTQL-JSGCOSHPSA-N 274.364 3.492 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cccc(NC(C)=O)c1 160057965 FCKZGJBVFZNBEW-KGLIPLIRSA-N 291.439 3.026 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1ccncc1 160192775 KTDGDRYENWZSEP-LBPRGKRZSA-N 271.316 3.317 70 20 CGID CC(C)n1nccc1C(=O)Nc1cccc2[nH]ccc12 160270954 BJKVWOYACOLNHH-UHFFFAOYSA-N 268.320 3.198 70 20 CGID CC1(C)C[C@@H](NCc2csc(-c3ccco3)n2)CCO1 160434785 NPEJGFBNWODNJS-NSHDSACASA-N 292.404 3.450 70 20 CGID CCC[C@H](N)C(=O)N[C@@H](c1ccccc1Cl)C(C)C 160830022 JVBCHCFQKXSEEA-UONOGXRCSA-N 282.815 3.281 70 20 CGID Cn1cnnc1CN1CCC[C@H]1c1cccc2ccccc12 160843280 RTHCVQZEDRLDDP-KRWDZBQOSA-N 292.386 3.305 70 20 CGID CCc1ccccc1NC(=O)N[C@@H](CC)[C@H]1CCCO1 159522762 JJONILMEGUYFMX-DZGCQCFKSA-N 276.380 3.328 70 20 CGID CC[C@@H]1C[C@@H](Nc2ccc(F)c(OC)c2)CCO1 159967365 YQSYSJVLYUOSFY-NWDGAFQWSA-N 253.317 3.204 70 20 CGID C[C@H]1CCC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)C1 218630662 PEZRJATXXMRQAX-CMPLNLGQSA-N 287.812 3.197 70 20 CGID CCC(CC)NC(=O)N[C@@H](C)c1ccc(OC)cc1 217304919 SLJLNKNWYRSGSD-NSHDSACASA-N 264.369 3.244 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)Cc1cccc(Cl)c1 161413160 LVFYHABQWKMAOP-PHIMTYICSA-N 251.757 3.282 70 20 CGID Cc1cc(N[C@H]2CCO[C@H](c3ccccc3)C2)nc(C)n1 160528827 NJTMZGSOXWXYTN-HOTGVXAUSA-N 283.375 3.426 70 20 CGID CC1(NC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CCC1 160695742 HPNYFWUXPQMLFW-CABCVRRESA-N 288.391 3.149 70 20 CGID Cc1cnc([C@@H](C)NC(=O)NCC2(C3CC3)CC2)s1 159408202 ZTWNQJBOCVKPKR-SNVBAGLBSA-N 279.409 3.002 70 20 CGID CC[C@@H]1CCN(C(=O)c2cn(C)nc2-c2cccs2)C1 159429496 BMCCQVOMNGPEDD-LLVKDONJSA-N 289.404 3.021 70 20 CGID CC(C)n1nccc1C(=O)N1C[C@@H](C)CCC[C@@H]1C 159490582 USJSJWSIRCVLEY-STQMWFEESA-N 263.385 3.115 70 20 CGID CC(C)(Cc1ccccc1)C(=O)NCC1(N)CCCCC1 159545489 LNLZHMWHEHOYGE-UHFFFAOYSA-N 288.435 3.033 70 20 CGID Fc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c(F)c1 159616623 GZVXXRXIBPUTRW-YUELXQCFSA-N 279.330 3.012 70 20 CGID CC1(C)C[C@@H](NCc2cnc(C(C)(C)C)s2)CCO1 160434986 DRYHTUVLQRIMGC-NSHDSACASA-N 282.453 3.488 70 20 CGID CSCC[C@@H](C)N(C)C(=O)C[C@H](C)c1ccncc1 160711747 GJWCAHWORXDEPI-QWHCGFSZSA-N 280.437 3.175 70 20 CGID COc1ccc(Cl)c(N[C@@H]2C[C@H](C)N(C)C[C@@H]2C)c1 218052322 DIUICAGOWFFMNE-COPLHBTASA-N 282.815 3.489 70 20 CGID CN(C(=O)c1cccc2[nH]ccc12)c1ccc2c(c1)OCO2 160179927 ZFYJQUYLNBJOQC-UHFFFAOYSA-N 294.310 3.173 70 20 CGID CCC[C@@H](N[C@H]1CCc2nc(C)nn2C1)c1ccccc1 160296999 VXVWKTKZBDFZRU-JKSUJKDBSA-N 284.407 3.032 70 20 CGID CCc1ccc([C@H](C)C(=O)N(C)Cc2cccn2C)cc1 160484353 QXDMMFWVXMKYCR-AWEZNQCLSA-N 284.403 3.350 70 20 CGID Cc1ccc([S@@](=O)Cc2nccs2)cc1C 160631106 KRRMQOVRVTURKE-MRXNPFEDSA-N 251.376 3.068 70 20 CGID CC[C@@H](NC(=O)c1sc(C)nc1C)c1c(C)noc1C 160674463 NAFRUPMWQWZYLR-LLVKDONJSA-N 293.392 3.246 70 20 CGID CCCCOc1cccc(CN[C@@H]2CCN(C)C[C@@H]2C)c1 160823687 KJCHJVVSQNHVKW-MAUKXSAKSA-N 290.451 3.295 70 20 CGID CC(C)C[C@@H]1CCN(C(=O)C[C@@H](C)c2ccncc2)C1 160949367 FRNLLAQOENMMKJ-CABCVRRESA-N 274.408 3.470 70 20 CGID CC/C=C(/C)C(=O)Nc1ccccc1-c1nc(CC)n[nH]1 160959657 MWIDXWLIIIFONP-FLIBITNWSA-N 284.363 3.329 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCc1ccco1 159690538 YROHLFKUKIONKG-CHWSQXEVSA-N 275.373 3.112 70 20 CGID CN(C)[C@H](CNCc1cccc2cc[nH]c12)c1ccco1 218067653 RAHHXUHHAAZKBW-OAHLLOKOSA-N 283.375 3.153 70 20 CGID CCCOc1ccc(NC(=O)C(F)F)cc1OCCC 217663582 OIGMCUGLEQQWSE-UHFFFAOYSA-N 287.306 3.468 70 20 CGID O=C(OCCC1CC1)c1cc(Cl)nc(Cl)c1 217943835 OICHPCBCGITFGK-UHFFFAOYSA-N 260.120 3.345 70 20 CGID CC(C)Oc1cncc(C(=O)N2CCC[C@@H]3CCC[C@@H]32)c1 161318624 CTFIVJKUOPKJSD-BBRMVZONSA-N 288.391 3.274 70 20 CGID C[C@@H](NCC1(c2ccc(F)cc2)CC1)C1CCOCC1 161382635 HLWBIRDDLQNQLJ-CYBMUJFWSA-N 277.383 3.262 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1ccccn1 160152616 LBVZJMWURDHQMY-LBPRGKRZSA-N 271.316 3.317 70 20 CGID CCOCCCC(=O)O[C@H](c1ccccn1)C(F)(F)F 160244914 NVVMBJSBIPZWBS-GFCCVEGCSA-N 291.269 3.045 70 20 CGID CCOc1cc(C)ccc1NC(=O)C[C@H](C)SC 160380686 AUXKSXFLXOLTDD-NSHDSACASA-N 267.394 3.474 70 20 CGID C[C@H](NCC1(Sc2ccccc2)CC1)[C@H]1CCOC1 160479599 CZGAEOFOKMGWSO-KBPBESRZSA-N 277.433 3.326 70 20 CGID COC(=O)CN(Cc1cccs1)c1ccc(F)cc1 160486111 BIHMLFQOYPHZOL-UHFFFAOYSA-N 279.336 3.067 70 20 CGID Cc1ncc([C@@H](C)NCc2ccc(CN(C)C)cc2)c(C)n1 160865967 JBZUFTRZJNZQNS-CYBMUJFWSA-N 298.434 3.006 70 20 CGID CCC(C)(CC)C(=O)Nc1ccc(-c2ncn(C)n2)cc1 159631824 CJPVIKRWTJMWDC-UHFFFAOYSA-N 286.379 3.247 70 20 CGID CCC(C)(CC)C(=O)Nc1cccc(-c2ncn(C)n2)c1 159654272 OANFUAVKTPAJJK-UHFFFAOYSA-N 286.379 3.247 70 20 CGID Cc1ccc(CN[C@H](C)c2ccc(-n3cccn3)cc2)cn1 161297066 UESBJVBTPOXLJT-OAHLLOKOSA-N 292.386 3.427 70 20 CGID Cc1ccc(C(=O)N[C@H](C)CC(C)C)c(Br)n1 161356236 FEQCDPRFXDPPMH-SNVBAGLBSA-N 299.212 3.317 70 20 CGID CCCNC(=O)CSCc1c(C)cccc1C 161387870 KTEQCJOWNAIFMI-UHFFFAOYSA-N 251.395 3.063 70 20 CGID CC(C)NCCC(=O)NC1(c2ccccc2)CCCCC1 160049565 FSIQPBVGANKYSN-UHFFFAOYSA-N 288.435 3.350 70 20 CGID CC[C@@H](NC(=O)c1ccc(F)c(F)c1)c1c(C)noc1C 160055280 QFRABMOCYLYJTN-CYBMUJFWSA-N 294.301 3.451 70 20 CGID CCN(C(=O)C[C@@H](C)c1ccncc1)c1nc(C)cs1 160746887 XGNBKOOTXCNZEN-LLVKDONJSA-N 289.404 3.393 70 20 CGID Cc1ccccc1CS(=O)(=O)Nc1c(C)cccc1F 160830536 OISXNWJJOXAYEL-UHFFFAOYSA-N 293.363 3.384 70 20 CGID CCn1cc(CC(=O)NC2CC=CC2)c2ccccc21 160896235 GXIUZCVTNGQZAD-UHFFFAOYSA-N 268.360 3.039 70 20 CGID CCc1ccccc1C(=O)N1CCO[C@H](c2ccccc2)C1 160915365 VVTFNNFCGVWWEC-SFHVURJKSA-N 295.382 3.463 70 20 CGID Cc1ccc(O[C@H](C)C(=O)NCC2(C3CC3)CC2)cc1 159831236 DGWVNXFKXRUBKO-CYBMUJFWSA-N 273.376 3.069 70 20 CGID CCO[C@@H](CCNC(=O)c1ccc(Cl)nc1C)C(C)C 159652067 QTOSHOFWTSRURX-ZDUSSCGKSA-N 298.814 3.224 70 20 CGID Cc1n[nH]c(C)c1[C@@H](C)CC(=O)Nc1cccc2cn[nH]c12 159673288 PZYARXHAYHMTAN-VIFPVBQESA-N 297.362 3.035 70 20 CGID CC1CCN(c2cccc(NC(=O)NCC3CC3)c2)CC1 159698502 MVYRDIZCRZIAPF-UHFFFAOYSA-N 287.407 3.454 70 20 CGID COC(=O)c1sccc1NC(=O)c1cccc(C)c1F 159781110 ZEOOADOTOHKVGP-UHFFFAOYSA-N 293.319 3.235 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cc(F)c(F)c(F)c1 161466063 XAKTYKFTLUBRIP-OCAPTIKFSA-N 257.255 3.117 70 20 CGID Cc1occc1CN(C)CCCCn1ccnc1C 161475280 RSQPYXDHCKPVJZ-UHFFFAOYSA-N 261.369 3.005 70 20 CGID Cc1nc(CC(=O)Nc2nc(C3CC3)cs2)c(C)s1 160897897 WCHQWLLYCSSDSI-UHFFFAOYSA-N 293.417 3.275 70 20 CGID CCC(C)(C)OC[C@@H](CS(=O)(=O)Cl)C(C)C 114476989 RJHWHPLSWUHQEZ-JTQLQIEISA-N 270.822 3.032 70 20 CGID CSc1ccc(C(=O)N2CCc3c(F)cccc3C2)o1 161076670 QDVXPNZYVYDTCB-UHFFFAOYSA-N 291.347 3.339 70 20 CGID CCc1ccc([C@@H](C)N[C@H]2CCC[C@H](N(C)C)C2)o1 161141623 VOKWHUBYCHUZIT-RDBSUJKOSA-N 264.413 3.365 70 20 CGID CCN(C(=O)C[C@@H](C)SC)c1ccccc1C 160146550 CAOGKGMOQXRYPP-GFCCVEGCSA-N 251.395 3.490 70 20 CGID C[C@@H](N[C@@H]1CCCN(c2ccccc2F)C1=O)C1CCC1 160215805 IFLKJHUDSNBEMC-IUODEOHRSA-N 290.382 3.099 70 20 CGID CC1CCC(N(C)C(=O)N[C@H]2CCO[C@@H](C3CC3)C2)CC1 160505740 RIEDYSPEGRQWBD-OMFOHFGMSA-N 294.439 3.164 70 20 CGID CCc1nn(C)c(CC)c1CN(C)Cc1ccccc1C 160530396 NLWCJSMZGMRAFC-UHFFFAOYSA-N 285.435 3.485 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](C(C)C)C2CC2)c1 160636428 USLXPFHTXZVAJZ-KRWDZBQOSA-N 288.435 3.351 70 20 CGID CN(Cc1cccn1C)C(=O)C1(c2ccccc2)CCC1 160856338 BCFNOBNRKUXLTM-UHFFFAOYSA-N 282.387 3.105 70 20 CGID COc1ccc(CN2CCC[C@@H]2c2cccc(C)n2)cn1 159711249 PIIHAGSTGKNVLV-MRXNPFEDSA-N 283.375 3.131 70 20 CGID CC(C)[C@@H](CCO)NC(=O)C[C@H](C)C1CCCCC1 160760286 LUAWXOXZKIYPIU-DZGCQCFKSA-N 269.429 3.116 70 20 CGID Cc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)cc1C 218129199 GRDZHIMHAJTXTR-SJORKVTESA-N 258.409 3.020 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1F 161038270 NFXMAOUGOGQYBE-BNOWGMLFSA-N 282.378 3.488 70 20 CGID C[C@@H]1CCC[C@H](C(=O)NC2CCN(C(C)(C)C)CC2)C1 161200843 UCYQJILLRKJGOT-KGLIPLIRSA-N 280.456 3.192 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@@H]1CCC(C)C 161427872 RHQKVMLWVZMQQW-OAHLLOKOSA-N 278.444 3.397 70 20 CGID CC(C)(C)c1nsc(NCC[C@@H]2CCCCO2)n1 160308438 KWJAKIIFYGGUEQ-JTQLQIEISA-N 269.414 3.207 70 20 CGID C[C@H](CCc1cccc(F)c1)NC[C@H]1CCCC[C@@H]1O 160537067 OWMDJWIPHWXERU-UNEWFSDZSA-N 279.399 3.288 70 20 CGID CC[C@H](NC(=O)C1(C)CCC1)c1c(C)noc1C 160570347 YFCYQZVKGAQKSD-NSHDSACASA-N 250.342 3.049 70 20 CGID CCc1ccc(/C=C/C(=O)NCC(C)(C)SC)o1 160628036 SXTDQTIHDBEXHZ-CMDGGOBGSA-N 267.394 3.113 70 20 CGID CCO[C@H]1C[C@@H](NCC2(N(C)C)CCCC2)C12CCCC2 160676058 HQVGSEHWRQUIER-CVEARBPZSA-N 294.483 3.188 70 20 CGID CC(C)c1cc(=O)n(CCCCC(F)(F)F)cn1 160741458 LHEKUMZOZUJFOY-UHFFFAOYSA-N 262.275 3.099 70 20 CGID CCCCOc1cccc(CN[C@@H](C)c2cnn(C)c2)c1 160823934 HMWKDGHKWVPNGI-AWEZNQCLSA-N 287.407 3.450 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCCc1cccc(Cl)c1 159839571 FLIIAIFRNYFMJC-ZFWWWQNUSA-N 265.784 3.435 70 20 CGID CCCCCOc1cccc(NC(=O)c2cnn(C)c2)c1 159703643 DFVVPWVDMWGNBU-UHFFFAOYSA-N 287.363 3.241 70 20 CGID O=C(C1=CCCC1)N(Cc1ccco1)CC(F)(F)F 159523824 FYLGIFYWMRFNEB-UHFFFAOYSA-N 273.254 3.281 70 20 CGID CCC(C)(C)NC(=O)[C@H](C)N[C@@H](C)c1cccc(F)c1F 159533696 JVFHLQNGMMCJHH-QWRGUYRKSA-N 298.377 3.309 70 20 CGID Cc1cc(N[C@H]2CCCc3cc(N)ccc32)ccn1 159495605 NSWRWPLNTSSHIV-INIZCTEOSA-N 253.349 3.462 70 20 CGID C[C@@H](c1nc(C2CC2)no1)N(C)OCc1ccccc1 159591192 MXBJRHYTNMITBH-NSHDSACASA-N 273.336 3.072 70 20 CGID CN(Cc1csc(-c2ccsc2)n1)[C@@H](CN)C1CC1 160086535 ZATIQZSZUCGSGZ-ZDUSSCGKSA-N 293.461 3.041 70 20 CGID Cc1ccc(CCNC(=O)NCCc2cccc(C)c2)cc1 217307944 WWFXJFOGIIMPSU-UHFFFAOYSA-N 296.414 3.388 70 20 CGID COCCCCCS[C@@H](C)C(=O)OC(C)(C)C 161336271 WLTAQLDHLWHONN-NSHDSACASA-N 262.415 3.267 70 20 CGID COC(=O)c1ccc(NCC2(C(C)C)CC2)nc1C 218062599 ONPJLTVALNTUEU-UHFFFAOYSA-N 262.353 3.025 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)o1 161206932 IDEWMSKZSOZRCB-KFWWJZLASA-N 289.375 3.136 70 20 CGID CC(=O)c1csc(C(=O)OCc2nc(C)sc2C)c1 161254155 VCRJTORJFLERFZ-UHFFFAOYSA-N 295.385 3.381 70 20 CGID COCCCCC(=O)O[C@@H](C)c1cc(C)ccc1OC 160160782 XWASZWRPOZTZAG-ZDUSSCGKSA-N 280.364 3.425 70 20 CGID CC(C)[C@H]1CCCCN1C(=O)Nc1cccc(F)n1 160809990 QLEALGITYCSUOZ-LLVKDONJSA-N 265.332 3.263 70 20 CGID C[C@H](NCCC(C)(C)O)c1nc(C(C)(C)C)cs1 159838241 XXGUSBPKKPVLFO-JTQLQIEISA-N 270.442 3.252 70 20 CGID C[C@@H]1C[C@@H]1c1cc(NC(=O)c2ccn(C3CCCC3)n2)[nH]n1 159681506 CJARMIJZYVGOFT-PWSUYJOCSA-N 299.378 3.097 70 20 CGID Cc1nc(CC(=O)N2CCC[C@H]2C2CCCC2)c(C)s1 159532076 TZIGGSLFZYIKMH-HNNXBMFYSA-N 292.448 3.484 70 20 CGID CSC[C@H]1CCCN1C(=O)Nc1ccnc(C)c1Cl 159385000 XWMDCJQDLGZAPV-SNVBAGLBSA-N 299.827 3.403 70 20 CGID CC(C)Oc1ccc(CNCC2(CO)CCCC2)cc1 160098766 YBLPIOVGNIWRSF-UHFFFAOYSA-N 277.408 3.116 70 20 CGID Cc1cccc([C@H](C)N[C@H](C)c2cn(C)nc2C)c1 160182224 NDNQDPDLFYKMNH-QWHCGFSZSA-N 257.381 3.449 70 20 CGID CN(C)C1(CNCc2cccc3cc[nH]c23)CCCC1 218079265 UKXYZUMQLHETBF-UHFFFAOYSA-N 271.408 3.132 70 20 CGID CCC[C@H]1CCCN(C(=O)NCc2ccc(OC)cc2)C1 161423282 HOFZCYMSGPTPMU-HNNXBMFYSA-N 290.407 3.417 70 20 CGID CC(C)(C)C[C@H](CO)Nc1nc2cc(F)ccc2o1 161438198 WPGDEVMJVJFLIJ-SNVBAGLBSA-N 266.316 3.176 70 20 CGID Cc1ccsc1CNC(=O)c1cccc(C)c1F 161481931 BGCMWINZYVUJAY-UHFFFAOYSA-N 263.337 3.434 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@@H]1c1c(F)cccc1F 160090130 OYMHLNMUUIRKTP-RYUDHWBXSA-N 291.341 3.375 70 20 CGID CCCCO[C@H](C)C(=O)N[C@@H]1CCCc2sccc21 160186003 QRIPUDIZSFGOPS-DGCLKSJQSA-N 281.421 3.447 70 20 CGID C[C@H]1CCC[C@H](C(=O)N(C)Cc2nccn2C(F)F)C1 159900628 AAUIHGAAJWWHNH-QWRGUYRKSA-N 285.338 3.063 70 20 CGID CCO[C@@H]1C[C@H](N[C@H](C)c2ccccn2)C12CCC2 160832777 UWJVLICHGSEJOZ-VHDGCEQUSA-N 260.381 3.080 70 20 CGID Cc1cccc(CN[C@H]2CCN3CCCC[C@@H]23)c1C 218044665 IOAPMOAVHXIKIV-IRXDYDNUSA-N 258.409 3.020 70 20 CGID CCc1ccccc1C(=O)N1CCc2ccccc21 161043587 PEWQXYJLHVYETK-UHFFFAOYSA-N 251.329 3.452 70 20 CGID CCNCC1CCN(C(=O)C[C@@H](C)c2ccccc2)CC1 161059005 IBURZCOXEAFLCW-OAHLLOKOSA-N 288.435 3.028 70 20 CGID CC(C)C1CCN(C(=O)[C@@H]2CCCCCC[C@H]2N)CC1 161269569 QRWVKLUXSQTXCL-HZPDHXFCSA-N 280.456 3.179 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc2c(c1)OCO2 161271740 FHLZACXRBHXOMF-TZMCWYRMSA-N 289.375 3.456 70 20 CGID COc1ccc(CC[C@H](C)NC(=O)C[C@@H](C)SC)cc1 161389604 ZXFXFRMOVZKJTM-QWHCGFSZSA-N 295.448 3.274 70 20 CGID CCCCNC(=O)[C@H](C)SCc1c(CC)noc1C 160018874 AZJWMVWPDMPTEU-NSHDSACASA-N 284.425 3.083 70 20 CGID CCn1cc([C@H](C)NC[C@H](C2CCCCC2)N(C)C)cn1 160389942 CZBUOVKLKNHOGS-WMLDXEAASA-N 292.471 3.064 70 20 CGID CC[C@@H](C)OCC(=O)N[C@@H](C)c1c(F)cccc1Cl 160441752 XWNWBCBSIYOAGU-ZJUUUORDSA-N 287.762 3.471 70 20 CGID COc1ccccc1CC(C)(C)Nc1ccnc(C)n1 160448716 IRIHKTSQXFPRHW-UHFFFAOYSA-N 271.364 3.227 70 20 CGID C[C@H](CC(=O)N(C)Cc1cccn1C)c1ccccc1F 160482717 ZLLRCBNBVVTFMQ-CYBMUJFWSA-N 288.366 3.316 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cc(Cl)c[nH]1 160496744 ADIOEJYAQMADMX-LBPRGKRZSA-N 296.798 3.280 70 20 CGID COc1ccc2ccccc2c1CNC(=O)[C@H]1CCCCO1 160881647 LXKZVDYCDBYJPG-QGZVFWFLSA-N 299.370 3.034 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1csc(COC)n1 160983895 LCCWHLWGYSHOAZ-WCQYABFASA-N 296.436 3.330 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cccc(-n2cccn2)c1 159626764 RNSPQVMNRJOVDP-CZUORRHYSA-N 283.375 3.181 70 20 CGID CC(C)n1cccc1C(=O)N[C@H](C)Cc1ccc(O)cc1 159831326 VHYMPQRTBDMRGM-CYBMUJFWSA-N 286.375 3.136 70 20 CGID C[C@H](Sc1ccncc1)C(=O)N(C)c1ccccc1 159869629 IUTNTSROIGEEBJ-LBPRGKRZSA-N 272.373 3.225 70 20 CGID CCC(CC)[C@@H]1C[C@@H](N[C@@H](C)CCn2cccn2)CCO1 159496629 OGOPAYLUYGQQPN-XIRDDKMYSA-N 293.455 3.235 70 20 CGID CCCSCC(=O)N(C)c1ccc(OC)c(Cl)c1 159926782 NXPXQEJWXNJIGD-UHFFFAOYSA-N 287.812 3.455 70 20 CGID Cc1ccc(NC(=O)CCCn2cccc2)c(CN(C)C)c1 159541290 CIWHYTNJWUKCGH-UHFFFAOYSA-N 299.418 3.277 70 20 CGID CCCCCN(CCCCC)C(=O)c1cccc(=O)n1C 159952658 ZMEKIWSVVGCSIA-UHFFFAOYSA-N 292.423 3.208 70 20 CGID O=S(=O)(Cl)CCCCOC1CCCCCC1 114258449 IBZUAMJUJPAZCK-UHFFFAOYSA-N 268.806 3.075 70 20 CGID CC[C@@H](NC(=O)C(F)(F)F)c1ccc(F)cc1F 217847903 ABFORORTDMCWJG-SECBINFHSA-N 267.197 3.094 70 20 CGID Cc1ccc([C@@H](C)NCCNC(=O)OC(C)(C)C)cc1C 218166556 CPDBSRMIIYKJEV-CQSZACIVSA-N 292.423 3.479 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)Cc1c(C)nn(C)c1C 161282908 AMZVEYYBXVLIFT-GOEBONIOSA-N 291.439 3.007 70 20 CGID Cn1ncc2c1CCC[C@H]2NCC1(c2ccc(F)cc2)CC1 161379671 HRDWAKZYHRLSEB-MRXNPFEDSA-N 299.393 3.258 70 20 CGID Fc1ccc(Cn2nc(C3CC3)nc2C2CC2)cc1 161440912 GGLODOJDCUFZKC-UHFFFAOYSA-N 257.312 3.220 70 20 CGID CCOCCC1(CNC(=O)N2C[C@H]3CCCC[C@H]3C2)CC1 161466780 PNRIXNDOEKXQAH-GASCZTMLSA-N 294.439 3.025 70 20 CGID CSc1ccc(C(=O)NCC2(C3CC3)CC2)cc1 160064704 XMFXHOFBEONBTD-UHFFFAOYSA-N 261.390 3.329 70 20 CGID CCc1ccccc1NC(=O)N(C)CCc1nccs1 160104534 SOHQKBQODLJWRH-UHFFFAOYSA-N 289.404 3.412 70 20 CGID CNC(=O)c1ccc(NC(=O)C[C@@H](C)C(C)C)c(Cl)c1 160230327 SGDWKIBIAASHJM-SNVBAGLBSA-N 296.798 3.320 70 20 CGID C1CNC[C@@H](c2noc(C3C4CC5CC(C4)CC3C5)n2)C1 160248899 FSIVXTNLLYWGTL-FZLLLIJMSA-N 287.407 3.076 70 20 CGID C[C@H]1CCC[C@H](CC(=O)N(C)Cc2cccn2C)C1 160712991 CVJNDZQYGXGAAO-KBPBESRZSA-N 262.397 3.200 70 20 CGID Cn1cnnc1CSc1c(Cl)cccc1Cl 160938213 PKXRTQWVHMEUJX-UHFFFAOYSA-N 274.176 3.414 70 20 CGID CCCCNC(=O)Nc1ccc(CCC(=O)OCC)cc1 159609981 HWVGZBJGONQNHW-UHFFFAOYSA-N 292.379 3.104 70 20 CGID CC[C@H](NC(=O)Nc1cc(C)ccc1OC)[C@H]1CCCO1 159412940 CJZYTSZICAQIHQ-SWLSCSKDSA-N 292.379 3.083 70 20 CGID CC(C)C[C@H]1CCN(C(=O)c2ccc(N(C)C)cc2F)C1 159436980 KKVJWCGMVSPXRC-CYBMUJFWSA-N 292.398 3.400 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)N2CCO[C@H](c3ccccc3)C2)C1 159687850 BROHCDNPAQBBLN-OIISXLGYSA-N 287.403 3.413 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cc(C)ccc1C 159693855 HZQJCAHRQUQWKZ-UHFFFAOYSA-N 278.396 3.224 70 20 CGID CC(C)c1cnc(NCC2(C)CCOCC2)s1 159532945 LJOKGXMAEGPTAZ-UHFFFAOYSA-N 254.399 3.495 70 20 CGID CCc1noc(C)c1CNc1ccc(C(=O)NC2CC2)cc1 159378415 JLFRTFLIVKIAEN-UHFFFAOYSA-N 299.374 3.050 70 20 CGID COc1ccc2c(c1)C[C@H](NC[C@H](C)C1CC1)CC2 159554861 FRFMRLAXCUBWIP-BLLLJJGKSA-N 259.393 3.188 70 20 CGID COC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(C)C 218019888 WMXQKXULVQJOKU-UHFFFAOYSA-N 278.739 3.436 70 20 CGID CC[C@@H](C)N(C)CCNc1nc2ccccc2s1 217365913 YVOGEXMUXZHCHU-LLVKDONJSA-N 263.410 3.439 70 20 CGID CS[C@H](C)CC(=O)NCCc1ccccc1Cl 161399408 ZWXFCOLESWRWLY-SNVBAGLBSA-N 271.813 3.140 70 20 CGID CC[C@H](C)N(C)CCNCc1cccc(OC(C)C)c1 217395015 NDOGJNGJDSQRHF-HNNXBMFYSA-N 278.440 3.294 70 20 CGID Cc1n[nH]c(C)c1CN(C)Cc1cccc(Cl)c1 161136325 BPFSRQWATYZZBM-UHFFFAOYSA-N 263.772 3.312 70 20 CGID CCCCC(=O)Nc1ccccc1-c1nc(CC)n[nH]1 161203037 AZHKPIXXCKJURO-UHFFFAOYSA-N 272.352 3.163 70 20 CGID O=C([C@@H]1CCCCO1)N1CCCSc2ccccc21 160033091 GEBYZAKCBALCKJ-ZDUSSCGKSA-N 277.389 3.085 70 20 CGID CCC[C@H](N[C@H]1CCc2nc(C)nn2C1)c1ccccc1 160296863 VXVWKTKZBDFZRU-HOTGVXAUSA-N 284.407 3.032 70 20 CGID CCOc1ccccc1[C@H](CC)NCc1n[nH]c(CC)n1 160324257 IRTMYPMFLLDPID-ZDUSSCGKSA-N 288.395 3.007 70 20 CGID CC[C@@H](C)OCC(=O)N[C@@H](c1ccccc1)C(F)(F)F 160478653 XZEUTJQYCAORGS-MFKMUULPSA-N 289.297 3.221 70 20 CGID CC[C@@H](NC(=O)[C@H](C)OCCC(C)C)c1c(C)noc1C 160600712 BZHUAHZQWXJQLQ-UONOGXRCSA-N 296.411 3.310 70 20 CGID Cc1cccc2ncnc(N[C@H]3CCOC(C)(C)C3)c12 160718486 UVSZEJKTJFWCHB-LBPRGKRZSA-N 271.364 3.308 70 20 CGID CCOc1ccccc1NC(=O)N[C@H](CC)[C@H]1CCCO1 159455945 CIBKWADHGFLFTK-TZMCWYRMSA-N 292.379 3.164 70 20 CGID OCCN[C@H](Cc1ccc(F)cc1)c1ccccc1Cl 159716504 YUYLHZAZPKFSTB-MRXNPFEDSA-N 293.769 3.345 70 20 CGID C[C@H]1CN(C(=O)Nc2cccc3ccccc23)CC[C@H]1O 159366202 PDTYYWOBPKUNDF-BLLLJJGKSA-N 284.359 3.074 70 20 CGID c1cc([C@H]2CCCN2CCCN2CCCCC2)ccn1 161459915 HLONFDQAUHMAMV-QGZVFWFLSA-N 273.424 3.095 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NCCc1cccnc1)C2 218477492 MNMPEDOPWWYESA-ZOBUZTSGSA-N 258.409 3.429 70 20 CGID CC[C@H](C)NC(=O)c1cccc(CN[C@H](C)C2(C)CC2)c1 161117551 LFIYNVCVWHBCRE-UONOGXRCSA-N 288.435 3.493 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 161125085 DRVOPGQVGQFJSC-ZFWWWQNUSA-N 292.354 3.213 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccc(OC)cc2)c1C 161150467 FMWWQFLJYCCPQN-UHFFFAOYSA-N 287.363 3.171 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc2c(c1)OCO2 161271866 FHLZACXRBHXOMF-GXTWGEPZSA-N 289.375 3.456 70 20 CGID CC/C=C(/C)C(=O)NC[C@@H]1[C@H]2c3ccccc3C[C@@H]12 161456456 DSQTWDVLNHMXCO-JJMJRCJSSA-N 255.361 3.045 70 20 CGID COc1ccccc1C(C)(C)NC(=O)Nc1ccc(C)nc1 161467711 FBROEPYNRFMRSE-UHFFFAOYSA-N 299.374 3.455 70 20 CGID CCN(CC)[C@@H](C)CNC(=O)c1ccc2nc(C)ccc2c1 161510064 SVHVHTGPFGWXGU-AWEZNQCLSA-N 299.418 3.003 70 20 CGID COc1cc(N[C@H]2CCOC(C)(C)C2)ccc1F 160070116 SKNDAMSEBGJXHV-NSHDSACASA-N 253.317 3.204 70 20 CGID CC[C@H](C(=O)N[C@@H](C)CSC)c1ccc(F)cc1 160205020 YOCHNAWNVOZYBO-GWCFXTLKSA-N 269.385 3.187 70 20 CGID COc1ccc(Cc2noc(-c3cc(C(C)C)on3)n2)cc1 160827331 BXAYKZJOMOMENI-UHFFFAOYSA-N 299.330 3.447 70 20 CGID NC(=O)Cc1ccc(NCc2coc3ccccc23)cc1 159810314 SWXQUBHMLKRLOB-UHFFFAOYSA-N 280.327 3.073 70 20 CGID CC(C)Cc1nnc(NC(=O)N[C@@H](C)C2CCC2)s1 159498318 VYZQYCDLIYFQLZ-VIFPVBQESA-N 282.413 3.047 70 20 CGID CC[C@H](C)OCC(=O)Nc1ccc(N(C)C)c(Cl)c1 159736103 ZXHFFBGXPDIFSF-JTQLQIEISA-N 284.787 3.160 70 20 CGID COCCCn1ccc(N[C@@H](C)c2ccccc2C)n1 159780519 ARUNSUAJJFDLME-AWEZNQCLSA-N 273.380 3.401 70 20 CGID COc1cc(NCc2ccc3c(c2)CCO3)ccc1F 160031306 OPONULQTFIVPNV-UHFFFAOYSA-N 273.307 3.381 70 20 CGID CNC(=O)c1ccc(NCc2cc(F)cc(Cl)c2)cc1 160844397 ODGZORBOJOEYHH-UHFFFAOYSA-N 292.741 3.451 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1ccc(C)cc1 161034735 UYDUCZIOVFRIML-SFHVURJKSA-N 263.362 3.162 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cccnc1Cl 161047975 ZCNHJGPIAFKNQF-AGIUHOORSA-N 281.831 3.258 70 20 CGID O=C(NC1CC=CC1)C1(c2cccc(F)c2)CCC1 161070740 RXUQCPIIPHLGHD-UHFFFAOYSA-N 259.324 3.082 70 20 CGID COc1ccc(NC(=O)C[C@@H]2CCC[C@@H](C)C2)cc1N 161230680 WKDGMBOBHDQJSQ-VXGBXAGGSA-N 276.380 3.432 70 20 CGID COc1ccc(CN(C)[C@@H](C)C(=O)OC(C)C)cc1Cl 161239628 GBXKKSNSRBSGEB-NSHDSACASA-N 299.798 3.121 70 20 CGID CC(C)c1nccc(N(C)[C@H](CCO)c2ccccc2)n1 160381801 BRVMONZXDUMUDR-OAHLLOKOSA-N 285.391 3.160 70 20 CGID C[C@@H](C(=O)NCc1ccccc1)c1c(F)cccc1F 160598839 LZGKKPLNJAEVMP-LLVKDONJSA-N 275.298 3.385 70 20 CGID O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1ccc(O)c(Cl)c1 160616251 PKFMUGADDIZREN-APHBMKBZSA-N 299.757 3.114 70 20 CGID Cc1cnc(C)c(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160630626 MAGNVFOYSBEVAH-HOTGVXAUSA-N 283.375 3.426 70 20 CGID CCn1cc([C@H](C)NCCCCc2nc(C)cs2)cn1 160684246 MSVXCXNXAJTICH-ZDUSSCGKSA-N 292.452 3.341 70 20 CGID CCOc1ccccc1N(C)Cc1cnc2ccccn12 159439811 LXMDBKMGLXQCAY-UHFFFAOYSA-N 281.359 3.369 70 20 CGID C[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1)C1CCC1 159979419 CVKLSGNXSWWRNG-VIFPVBQESA-N 289.347 3.283 70 20 CGID COc1cc(NC2CCN(C(C)C)CC2)ccc1F 160016497 OMHJTJGRWXWBJG-UHFFFAOYSA-N 266.360 3.119 70 20 CGID COC(=O)c1csc(NC(=O)N[C@@H]2CCCC2(C)C)c1 161030024 XGOMGWNSXIEIFP-SNVBAGLBSA-N 296.392 3.235 70 20 CGID CC(=O)c1c(C)nc(C)nc1SCc1nccs1 161255942 ODGNLTQWHAOCBE-UHFFFAOYSA-N 279.390 3.045 70 20 CGID CS[C@H](C)CNC(=O)[C@H](C)Cc1ccccc1Cl 161310416 BAAHPKDPQURDCO-GHMZBOCLSA-N 285.840 3.386 70 20 CGID C[C@H](CC1CC1)NC(=O)N1CCO[C@@H](c2cccs2)C1 160412854 ABLBVBSBXHETHN-DGCLKSJQSA-N 294.420 3.020 70 20 CGID COCCN(Cc1ccccc1)Cc1ccc2cn[nH]c2c1 160441207 XCLAQSGOFMFIHL-UHFFFAOYSA-N 295.386 3.212 70 20 CGID CC(C)[C@@H]1CN(C(=O)C[C@H](C)c2ccncc2)CCS1 160826916 PQRAACXXKVJKEW-ZFWWWQNUSA-N 292.448 3.175 70 20 CGID COCC(C)(C)C(=O)N[C@@H]1CCSc2c(F)cccc21 160941638 PVILCONIECUQPK-GFCCVEGCSA-N 297.395 3.151 70 20 CGID O=C(CCc1ccoc1)N[C@@H]1CCOC2(CCCCC2)C1 160943205 NLQNJMRFHFXHRD-OAHLLOKOSA-N 291.391 3.210 70 20 CGID C[C@H](NCCC(C)(C)O)c1ncc(-c2ccccc2)o1 159885753 GRYIIYILWRYEQG-LBPRGKRZSA-N 274.364 3.153 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@@H]2C[C@@H]2C)C1 159528471 OHZHKVQVCWFOPC-SDDRHHMPSA-N 261.390 3.417 70 20 CGID CC[C@H](NCC(=O)NCC(C)C)c1cccc(Cl)c1 159381438 FYWQIYRORFHSFU-AWEZNQCLSA-N 282.815 3.153 70 20 CGID CC[C@@H](C)CNC(=O)c1c(F)cccc1Br 160968619 UXMAFECIHWJKST-MRVPVSSYSA-N 288.160 3.364 70 20 CGID COc1ccc(NC(=O)/C=C/C2CCCCC2)cc1N 161078158 OUGAYVIYQHEXDP-JXMROGBWSA-N 274.364 3.352 70 20 CGID C[C@@H]1CC[C@@H](C)N1c1ncnc2c1cnn2-c1ccccc1 161443330 PQTKGBCTPMZGIN-CHWSQXEVSA-N 293.374 3.193 70 20 CGID Fc1ccc(Cn2nc(C3CC3)nc2C2CC2)c(F)c1 161487706 RHTLLXCOJDTCTI-UHFFFAOYSA-N 275.302 3.359 70 20 CGID Cc1cc(NC(=O)CCN2CCCC[C@@H]2CC(C)C)no1 160331075 GWNSUPBOMWGPGV-CQSZACIVSA-N 293.411 3.212 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1CSCCS1 160421345 FXYNAXQOLLSZKQ-PWSUYJOCSA-N 299.486 3.090 70 20 CGID CC[C@H](CC(=O)N(C)c1ccc2c(c1)OCO2)C(C)C 160504613 OGXFRYLJMPQEIL-GFCCVEGCSA-N 277.364 3.450 70 20 CGID CCCCOc1cccc(CN[C@H](C)[C@H]2CCOC2)c1 160818007 RRMQXGJXUXDUFP-ZBFHGGJFSA-N 277.408 3.380 70 20 CGID CC(C)NCCC(=O)N[C@@H](C)CCC1CCCCC1 160914830 OWHQTRARIBVDCI-AWEZNQCLSA-N 268.445 3.240 70 20 CGID CC[C@H](NC[C@@H]1CCc2ccccc21)[C@H]1CCOC1 160994194 URQMWVYICJHHHU-ZOBUZTSGSA-N 259.393 3.121 70 20 CGID O=S(=O)(Cc1ccccc1)N1CCC[C@H]2CCCC[C@H]21 159472383 NPBUMLKIJCUSTA-HZPDHXFCSA-N 293.432 3.171 70 20 CGID CCn1cc([C@@H](C)NC[C@H](C)N2CCc3ccccc32)cn1 159924694 PYRBMQQHZQPAJL-LSDHHAIUSA-N 298.434 3.005 70 20 CGID CCOc1cccc(CN[C@H](CC)c2cnn(C)c2)c1 159382225 GKPCCUCOWMAJLL-MRXNPFEDSA-N 273.380 3.060 70 20 CGID C[C@@H](CCc1ccccc1)SCCN1CCOCC1 159995916 JQDMDYGHAXMYAI-HNNXBMFYSA-N 279.449 3.073 70 20 CGID C[C@H](Nc1nc(C(C)(C)C)ns1)C1CCOCC1 159984415 BYPJHOLPLSIOJY-VIFPVBQESA-N 269.414 3.063 70 20 CGID CC(C)c1ccc(C(=O)NCCc2ccc(F)cc2)cn1 159596286 PBGLOIQDQXWEOU-UHFFFAOYSA-N 286.350 3.317 70 20 CGID CCCCOCCCN[C@@H](C)C[C@H]1CCCCCN1 160259395 LTWAHOUDPWRRMX-JKSUJKDBSA-N 270.461 3.094 70 20 CGID C[C@H](NC(=O)C(F)F)c1cccc(C(F)(F)F)c1 217636938 FEIDVESWXKFSHF-LURJTMIESA-N 267.197 3.148 70 20 CGID CC[C@H](C)NC(=O)COc1ccc([C@H](C)CC)cc1 217342148 KQLQCABYJIISAI-OLZOCXBDSA-N 263.381 3.494 70 20 CGID O=C(c1cc[nH]n1)N1CCCC[C@@H]1CCCc1ccccc1 161180260 WHTTVLBUEASFHH-MRXNPFEDSA-N 297.402 3.427 70 20 CGID CCC[C@@H](C)C(=O)Nc1ccc(C(=O)NC)cc1Cl 160259977 YNKKQSCVPQFGLL-SECBINFHSA-N 282.771 3.074 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cccc(Nc2cnn(C)c2)c1 160407655 CFCUHEHLSLBKQN-BETUJISGSA-N 298.390 3.177 70 20 CGID CCCC1(CNC(=O)c2ccnc(SC)c2)CC1 160561076 SZLHQGFRXUCPJN-UHFFFAOYSA-N 264.394 3.114 70 20 CGID Cc1nc2ccccn2c1CN1CCC[C@H]2CCC[C@@H]21 160790086 NIMCDCMYHBFSNI-CABCVRRESA-N 269.392 3.407 70 20 CGID CC(C)c1ccc(C2(CNC(=O)CCN)CCCC2)cc1 159473182 BDTIXWYEAQDRPG-UHFFFAOYSA-N 288.435 3.087 70 20 CGID CCC[C@@H](N[C@@H](C)c1cccc(F)c1F)C(=O)OCC 159485858 VXOIPEXMPOZAPB-GXFFZTMASA-N 285.334 3.347 70 20 CGID C[C@@H](OCCCNC(=O)C1(C)CC1)c1ccccc1 159700508 IEZLZJIPHGYFBV-CYBMUJFWSA-N 261.365 3.071 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(F)c(F)c1)[C@@H]1CCCO1 159385524 HHEPKRUEJBLLGP-OLZOCXBDSA-N 284.306 3.044 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccnn1[C@@H](C)C1CC1 159587075 UKBSHZQJKKTHNN-ITDIGPHOSA-N 261.369 3.229 70 20 CGID CC(C)c1ccc(C(=O)NCC[C@H](O)c2ccccc2)cn1 159793433 ZKSJIXABTGJASG-KRWDZBQOSA-N 298.386 3.059 70 20 CGID c1ccc(-c2ccccc2CN2CCOCC2)cc1 218137370 ACTHPUXIHKVRME-UHFFFAOYSA-N 253.345 3.186 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCCC[C@H]2OC)cc1F 218197755 UGUMBIMBGCDTBJ-HZUKXOBISA-N 281.371 3.443 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1coc(Br)c1 161459842 NWKBIZGCJGWDQU-YUMQZZPRSA-N 272.142 3.055 70 20 CGID CC[C@H](NC(=O)c1cc(OC)cs1)c1c(C)noc1C 160039814 VLLXIIHVKZWSSH-NSHDSACASA-N 294.376 3.243 70 20 CGID FC(F)(F)c1ccc(NCc2cncs2)cn1 160065912 IGDZAENWHBBMGY-UHFFFAOYSA-N 259.256 3.169 70 20 CGID CCN(C(=O)NCCCC(=O)OC(C)C)C1CCCCC1 160120667 FKQDMHINQKPCBZ-UHFFFAOYSA-N 298.427 3.082 70 20 CGID CCCCCC(=O)Nc1ccc(C(=O)NC)cc1Cl 160293736 IKIQLMNJTULZRB-UHFFFAOYSA-N 282.771 3.218 70 20 CGID COCC1CCN(C(=O)C2CCC(C)(C)CC2)CC1 160321458 DWOPIGNRLZMBGJ-UHFFFAOYSA-N 267.413 3.088 70 20 CGID CCc1noc(C)c1CS(=O)(=O)c1ccc(C)c(C)c1 160342719 VRACIOAVBMEJGL-UHFFFAOYSA-N 293.388 3.136 70 20 CGID CCCCCCNC(=O)Nc1ccn(CC(F)(F)F)n1 160513574 IETGLMUKHKLROE-UHFFFAOYSA-N 292.305 3.147 70 20 CGID CCC(N)(CC)CNC(=O)CCCc1cc(C)sc1C 160560953 PLQMJVQIBNRBQY-UHFFFAOYSA-N 296.480 3.321 70 20 CGID CCCC1(CNC(=O)CSCc2cccnc2)CC1 160650478 QOFSNQHTPBLTER-UHFFFAOYSA-N 278.421 3.011 70 20 CGID CCC[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1cccc(F)c1F 159459985 QSDHZXYZVBZHGI-SRVKXCTJSA-N 298.377 3.309 70 20 CGID Cc1nc(C)c(CCNC(=O)[C@@H](C)c2ccsc2)s1 159504354 VLVAPROSYCOEIB-VIFPVBQESA-N 294.445 3.284 70 20 CGID CC(C)[C@@H]1CCCN(C(=O)NCCc2cscn2)CC1 159545151 BZKFYYUNUQZGIP-CYBMUJFWSA-N 295.452 3.153 70 20 CGID CCOC(=O)CN(Cc1ccc(OC)cc1)C1CCCC1 159775832 SBKLOSIBCNYOBO-UHFFFAOYSA-N 291.391 3.003 70 20 CGID Cc1cn2c(CN[C@H]3CCOC(C)(C)C3)c(C)nc2s1 160479062 HQOALCSMVQZACR-LBPRGKRZSA-N 293.436 3.060 70 20 CGID Cc1ccc(CCNC(=O)N2CCC[C@H](C)CC2)cc1 217225181 NSDKEYRLIFVOLL-AWEZNQCLSA-N 274.408 3.369 70 20 CGID C[C@@H](CCC(C)(C)C)NC(=O)N(C)Cc1cccn1C 161071522 VHNFZCATPXHLGV-ZDUSSCGKSA-N 279.428 3.381 70 20 CGID O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1cccnc1Cl 160008892 ABOYQVABKSOQRO-RBSFLKMASA-N 298.773 3.051 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1cscc1C 160113021 CMHVBTTYHBBZTR-CQSZACIVSA-N 287.384 3.482 70 20 CGID CCC[C@H](N[C@H](CCO)CSC)c1ccc(OC)cc1 160185305 UWYSVYIDRQKBMT-ZBFHGGJFSA-N 297.464 3.240 70 20 CGID CCc1ccc([C@@H](CC)N[C@H](CCO)CSC)cc1 160258687 GNGRHKIVAAAPLY-HZPDHXFCSA-N 281.465 3.404 70 20 CGID CCOc1cccc([C@H](C)NC(=O)NC2(C)CCC2)c1 160259595 YALWLJILMHXPIA-LBPRGKRZSA-N 276.380 3.388 70 20 CGID CN(CC(F)(F)F)C(=O)C1CCC(C)(C)CC1 160316589 QRUHENRAYNHDMZ-UHFFFAOYSA-N 251.292 3.224 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)C1CCCC1 160471647 IBYSZXMSMDPANH-AWEZNQCLSA-N 265.397 3.175 70 20 CGID CC(C)NC(=O)CN[C@@H](C)c1ccc(-c2ccccc2)o1 160993838 ONJCYUYVXKMEFD-ZDUSSCGKSA-N 286.375 3.122 70 20 CGID CCCCn1ncc(NC(=O)N[C@H]2CCC[C@@H]2C)c1C 159801091 SFHVANRKEOXCMM-AAEUAGOBSA-N 278.400 3.302 70 20 CGID CCc1ccccc1CNC(=O)c1cccc2[nH]cnc12 159652539 BALAWKIJHHAVLS-UHFFFAOYSA-N 279.343 3.055 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)c2ccncc2)C1 159665234 ZTZGNCGYTCEALS-GFCCVEGCSA-N 284.384 3.470 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)N(Cc2cccnc2)C2CC2)C1 159772084 QQMGSYGGXNEILU-UKRRQHHQSA-N 272.392 3.399 70 20 CGID CN(CCOCc1ccccc1)C(=O)CC(C)(C)C 159434407 XWGWYPCTMGTLHZ-UHFFFAOYSA-N 263.381 3.098 70 20 CGID CCO[C@@H]1C[C@H](N[C@@H]2CCOC(C)(C)C2)C12CCCC2 159940260 LFBGMZPEGIZZOB-QLFBSQMISA-N 281.440 3.271 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1F 160998928 KGSYORZOLLUYOG-MJBXVCDLSA-N 264.388 3.349 70 20 CGID Cc1ccccc1OCCCNC(=O)N1CCC(C)CC1 217300279 KNNBBWHYSTUGRH-UHFFFAOYSA-N 290.407 3.205 70 20 CGID COC(=O)c1ccnc(N[C@@H](C)c2ccc(C)s2)c1 217878742 MXNUBBITOBZUNF-JTQLQIEISA-N 276.361 3.411 70 20 CGID CC(C)Oc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCO2)cc1 161080803 GOYNNZBNXUQFAH-CJNGLKHVSA-N 291.391 3.220 70 20 CGID CNC[C@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C 161295022 FXUINKBGIIXIHI-BAESOJJISA-N 294.826 3.009 70 20 CGID CN1CCC[C@H]2CN(C(=O)C3CCC(C)(C)CC3)CC[C@H]21 161306480 VOWLTPNTNPWGNG-JKSUJKDBSA-N 292.467 3.146 70 20 CGID Cc1cc(C[C@H](C)NC(=O)CCC2CCCCC2)n[nH]1 161330187 AVORPNFGPAKFDJ-LBPRGKRZSA-N 277.412 3.126 70 20 CGID CC(C)OCCCC(=O)N[C@H]1CCCc2sccc21 160163699 LSHDEFFRNIHIAA-ZDUSSCGKSA-N 281.421 3.447 70 20 CGID Cc1nc2ccccn2c1CN1CCCC[C@@H]1c1cn[nH]c1 160408433 DSDYUBKSXXZUMG-OAHLLOKOSA-N 295.390 3.093 70 20 CGID Cc1ccnc(NC(=O)c2cc(F)cc3cccnc23)c1 160744057 BENAFCLCKPRYBG-UHFFFAOYSA-N 281.290 3.330 70 20 CGID Cc1ncc([C@H](C)NC2CC(C)(C)NC(C)(C)C2)c(C)n1 159608724 FFGHFLCLEAAIQK-LBPRGKRZSA-N 290.455 3.053 70 20 CGID CC(C)[C@H]1CN(C(=O)[C@H]2CCCCO2)c2ccccc2N1 159812626 YTJLLZSOGUVKIE-GDBMZVCRSA-N 288.391 3.039 70 20 CGID CCC[C@@H](C)CS(=O)(=O)N(C)[C@@H](CC)c1ccncc1 159742523 NJYUAMDCQXETCB-HIFRSBDPSA-N 298.452 3.231 70 20 CGID CCn1cc(NC(=O)CCCc2sccc2C)cn1 161446918 FLJFVUVAAIGAQI-UHFFFAOYSA-N 277.393 3.234 70 20 CGID CNC[C@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C 161294904 FXUINKBGIIXIHI-LWWSYDQCSA-N 294.826 3.009 70 20 CGID CCc1ccc([C@H](C)NC[C@@](C)(O)c2ccsc2)o1 160137056 KDJNLKJCEMDYQD-XHDPSFHLSA-N 279.405 3.462 70 20 CGID O=[S@](Cc1nccs1)c1cccc(Cl)c1 160658572 YKPKIJVRSTUPPB-HNNXBMFYSA-N 257.767 3.104 70 20 CGID CN(C[C@@H]1CCC[C@H]1O)C(=O)NCCCCC(C)(C)C 160787242 JRGCXVMTAIGUHG-UONOGXRCSA-N 284.444 3.005 70 20 CGID CCC[C@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 160987541 ADHGPSZDZTWJFU-KWQFWETISA-N 289.206 3.298 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)Cc1cccnc1 159467207 KNTSDPNKVZJACE-KBPBESRZSA-N 286.400 3.214 70 20 CGID C[C@@H]1CC[C@H](NC(=O)NCc2ccc(O)c(F)c2)[C@H](C)C1 159861296 QDSWAGCZGDHZMI-GYSYKLTISA-N 294.370 3.155 70 20 CGID COc1ccc(N(C)C(=O)c2cccc(F)c2F)cc1F 159476536 NQBNGSMYRHPEDJ-UHFFFAOYSA-N 295.260 3.389 70 20 CGID COc1ccc2[nH]cc(CC(=O)NCC3(C4CC4)CC3)c2c1 159929860 CPWSXOWDHINGGS-UHFFFAOYSA-N 298.386 3.025 70 20 CGID COc1ccc2nc(C)cc(C(=O)Nc3ccccn3)c2c1 159542257 OZIQQEOENCARAB-UHFFFAOYSA-N 293.326 3.199 70 20 CGID C[C@@H]1CN(C)[C@H](C)C[C@@H]1NCCCc1cccc(F)c1 159767527 PBYQQYMIKQOYOK-CPUCHLNUSA-N 278.415 3.077 70 20 CGID CS[C@H]1CCC[C@H](NCc2ccccc2NC(C)=O)C1 160465978 KDLMHDFPPFWNNS-GJZGRUSLSA-N 292.448 3.409 70 20 CGID Cc1cccc([C@@H](C)NS(=O)(=O)CCC(C)C)c1C 217215193 IWCVSJLJOPSGPL-CQSZACIVSA-N 283.437 3.330 70 20 CGID CS[C@H](C)CC(=O)N[C@@H](C)COc1cccc(C)c1 160847065 OHVOQWUHFDXLPS-QWHCGFSZSA-N 281.421 3.020 70 20 CGID CCCc1ccc(NCc2nnc3n2CCCC3)cc1 217318006 AIOIFRCKRLNLOR-UHFFFAOYSA-N 270.380 3.179 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cccnc1Cl 161047884 ZCNHJGPIAFKNQF-AVGNSLFASA-N 281.831 3.258 70 20 CGID CCCc1ccccc1NC1CCC(NC(C)=O)CC1 161077988 ZXXAWHKUDSJRPS-UHFFFAOYSA-N 274.408 3.498 70 20 CGID Cc1cnccc1CCNC(=O)N[C@H](C)CCC(C)(C)C 161381143 UWUGOUBDSSPTCG-CQSZACIVSA-N 291.439 3.447 70 20 CGID CCN(CC)[C@H](C)CNC(=O)CC/C=C/c1ccccc1 160066091 IIFGZTCUYNPDNQ-LRFDDAOPSA-N 288.435 3.327 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1 160133361 DCHQENAWTSJNPV-WMZOPIPTSA-N 288.435 3.013 70 20 CGID CN(CC1CCOCC1)C(=O)NCC(C)(C)C1CCCC1 160224581 WDRJZUBNQYBBRO-UHFFFAOYSA-N 296.455 3.271 70 20 CGID CC(=O)Nc1ccc(C)c(N[C@@H](C)C(=O)OC(C)(C)C)c1 160749567 MXPYYUXQGSYZAR-NSHDSACASA-N 292.379 3.096 70 20 CGID C[C@H](NCCO)c1ccc(SC2CCCC2)cc1 159720384 KIVOSRXPXNZULG-LBPRGKRZSA-N 265.422 3.364 70 20 CGID CCOc1ccc([C@@H](C)N[C@@H](C)[C@@H]2CCOC2)cc1OC 159946004 CBCAGXTXMOBTMI-VNHYZAJKSA-N 293.407 3.170 70 20 CGID CC(C)[C@@H]1CN(c2nc(C(C)(C)C)ns2)CCS1 159755789 PNVTVGFWBHEXSH-JTQLQIEISA-N 285.482 3.413 70 20 CGID CS[C@H](C)CC(=O)NCC1(c2ccc(F)cc2)CC1 159951609 RNFORBYPZIHMJK-LLVKDONJSA-N 281.396 3.115 70 20 CGID CC(C)c1ccc(C(=O)NCC[C@@H](O)c2ccccc2)cn1 159793557 ZKSJIXABTGJASG-QGZVFWFLSA-N 298.386 3.059 70 20 CGID CCCCCCCCOCCCS(=O)(=O)Cl 112356657 CPWJDULSLIZNGV-UHFFFAOYSA-N 270.822 3.322 70 20 CGID CN1CCN(Cc2ccc(F)cc2)[C@@H](c2ccccc2)C1 216731139 BPGFOJFTOFMIBE-GOSISDBHSA-N 284.378 3.314 70 20 CGID CCCC[C@H](CC)CNC1CCC(NC(C)=O)CC1 161215930 UNZGYYWYGIAOQX-FHERZECASA-N 268.445 3.240 70 20 CGID CC[C@H](C)CS[C@H]1CCCN(CC(F)(F)F)C1=O 160045882 CPQCAUVGWLZRQZ-UWVGGRQHSA-N 283.359 3.319 70 20 CGID Cc1nc(O)ccc1C(=O)N1CCC[C@@H]1C1CCCCC1 160126716 LXXOBTHLQWGICA-OAHLLOKOSA-N 288.391 3.281 70 20 CGID C[C@@H](Cc1ccccc1F)C(=O)NCC1(C2CC2)CC1 160183369 VOMBMZBQPDXPNX-LBPRGKRZSA-N 275.367 3.311 70 20 CGID c1ccc(CC2(CNc3cnccn3)CCC2)cc1 160509352 RXCOZLODGHTDRU-UHFFFAOYSA-N 253.349 3.302 70 20 CGID C[C@H]1CCC[C@@H](C(=O)NCCCCN2CCC[C@H](C)C2)C1 160635045 JVNILEALBWWLID-YESZJQIVSA-N 294.483 3.441 70 20 CGID Cc1ccc([C@H](NCc2nncn2C)c2ccccc2)cc1 160695543 KWKYDQSVHUSUHX-GOSISDBHSA-N 292.386 3.003 70 20 CGID CCCCCC(=O)NCCOc1ccccc1Cl 159408289 PYHZZBITMVMXQM-UHFFFAOYSA-N 269.772 3.415 70 20 CGID CCN(Cc1cccc(F)c1)C(=O)C1(CCOC)CCC1 159622104 JNUZFYHZAVEOPF-UHFFFAOYSA-N 293.382 3.381 70 20 CGID CCCN1CCC(NCCc2cc(C)cc(C)c2)CC1 159449939 RGJHMKVEPBZMLP-UHFFFAOYSA-N 274.452 3.310 70 20 CGID COCCCCC(=O)N[C@H]1CCCc2sccc21 159902102 IVEAKPUOBUZVRT-LBPRGKRZSA-N 267.394 3.058 70 20 CGID C[C@@]1(CNC(=O)N[C@@H]2CCc3ccccc32)CCCS1 159510720 HELUFNIPLJPDCP-ZBFHGGJFSA-N 290.432 3.259 70 20 CGID CC[C@H](C)C(=O)O[C@@H](c1ccccn1)C(F)(F)F 159936792 SJHNCOFXMATZFJ-WPRPVWTQSA-N 261.243 3.274 70 20 CGID CCCn1nccc1CN[C@@H](C)CCc1ccccc1 159984082 GYJWCUGUKHGLGE-HNNXBMFYSA-N 271.408 3.404 70 20 CGID CC1(C)C[C@H](NC2CC(c3ccccc3)C2)CCO1 159971943 NFYXNYUAAQLJJU-HWOWSKLDSA-N 259.393 3.480 70 20 CGID CC(C)[C@@H](CCO)NC(=O)c1csc2c1CC[C@H](C)C2 161288894 RUSVINJIXFXANG-SMDDNHRTSA-N 295.448 3.010 70 20 CGID CCC(CC)NC(=O)NCCc1ccccc1Cl 217305028 XPCYPCGKNMRGCF-UHFFFAOYSA-N 268.788 3.370 70 20 CGID CC(C)C[C@H](CO)NC(=O)C[C@@H](c1ccccc1)C(C)C 161202868 NRPPFQMHGSWWCM-IAGOWNOFSA-N 291.435 3.340 70 20 CGID Cc1ccc(NC(=O)N2C[C@H](C)CCC[C@@H]2C)cn1 161329464 KWFSDTCANCXTGZ-YPMHNXCESA-N 261.369 3.432 70 20 CGID COc1cc(NC2CCC(OC)CC2)ccc1F 160129391 OHOPMGVQVNCXOW-UHFFFAOYSA-N 253.317 3.204 70 20 CGID CC/C=C(/C)C(=O)NC[C@H](C[C@H](C)O)c1ccccc1 160167133 WGESNTOYUYHLOJ-KVGPOCCESA-N 275.392 3.014 70 20 CGID Cc1ccc(C(=O)CCN2CC[C@H](OCC(C)C)C2)cc1 160170035 QCDOONUIRQFECK-KRWDZBQOSA-N 289.419 3.315 70 20 CGID CC(=O)Nc1cccc([C@H](C)NC[C@H]2CCC(C)(C)O2)c1 160223681 LTSNVTMEUBMCEH-BLLLJJGKSA-N 290.407 3.253 70 20 CGID CCCCNc1ccccc1C(=O)N1C[C@H](C)O[C@@H](C)C1 160489414 AKUJGRXDOAQTTR-KBPBESRZSA-N 290.407 3.148 70 20 CGID COC(=O)CCCC(=O)N1CCC[C@@H](C)c2ccccc21 160518769 XUKJUPTYSIMDQF-CYBMUJFWSA-N 289.375 3.260 70 20 CGID COc1ccc2c(c1)CN(Cc1nccn1C(C)C)CC2 160847838 JKQOXXPYXBPYBJ-UHFFFAOYSA-N 285.391 3.031 70 20 CGID Cc1ccc(CNC(=O)NCCc2c(C)cccc2C)cn1 160924324 SRURCULKBGQDLG-UHFFFAOYSA-N 297.402 3.049 70 20 CGID CC[C@H](NC(=O)Nc1cc(C)ccc1OC)[C@@H]1CCCO1 159412679 CJZYTSZICAQIHQ-WFASDCNBSA-N 292.379 3.083 70 20 CGID FCCCSc1nnc(Cc2ccccc2F)o1 159424322 QPVRMDGBVJYCRU-UHFFFAOYSA-N 270.304 3.251 70 20 CGID Cc1n[nH]c(C)c1[C@H](C)CC(=O)Nc1cccc2cn[nH]c12 159673446 PZYARXHAYHMTAN-SECBINFHSA-N 297.362 3.035 70 20 CGID C[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCc1ccco1 159483285 IPMAUJXSCHQZAT-LBPRGKRZSA-N 291.778 3.471 70 20 CGID C[C@@H](O)C[C@@H](CNC(=O)c1cccs1)c1ccccc1 159777894 LAJIDUAWXOSYCH-OCCSQVGLSA-N 289.400 3.033 70 20 CGID CCn1nccc1CNC[C@H](c1ccccc1)C(C)C 159944075 YFNVSUBIWWDFKY-KRWDZBQOSA-N 271.408 3.432 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cccc(F)c1 161111476 LWCZMMHXEYBBES-WQVCFCJDSA-N 264.388 3.349 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@H](C)C(C)C)o1 161406407 BPXWKZNWVXFCBX-OCCSQVGLSA-N 279.380 3.382 70 20 CGID CSC[C@H](CCO)N[C@@H](C)c1cc(C)sc1C 160181521 DASFUPJPJNDKJS-JQWIXIFHSA-N 273.467 3.130 70 20 CGID O=C(C[C@@H]1C=CCC1)N[C@@H]1CCOC2(CCCCC2)C1 160402256 ITDKRSBVDUCOSG-HUUCEWRRSA-N 277.408 3.341 70 20 CGID C/C=C/COc1ccc(CC[C@@H](C)NCC(C)(C)O)cc1 160615244 AXSBDBSICIXUEN-LLYBFZRZSA-N 291.435 3.323 70 20 CGID CCc1cccc(OCCn2cnc(C(C)C)cc2=O)c1 160690226 OVQWMMNKFGEMHF-UHFFFAOYSA-N 286.375 3.008 70 20 CGID C[C@H](NC(=O)[C@H]1CCCCO1)c1ccc(OC(F)F)cc1 160862883 BMENNNVMGJNFSZ-GXFFZTMASA-N 299.317 3.034 70 20 CGID CCCc1ccc(C(=O)Cn2cnc(C(C)C)cc2=O)cc1 160893492 WLFIIBGFPAHVLZ-UHFFFAOYSA-N 298.386 3.202 70 20 CGID C[C@@H]1CCC[C@H](CNC(=O)c2ccc(CN(C)C)cc2)C1 160979944 WFKYAOFPZVPQEM-ZBFHGGJFSA-N 288.435 3.304 70 20 CGID Cc1nccn1-c1ncccc1NC(=O)[C@H]1CCC[C@H](C)C1 160982318 FJYTXAINGKFMNF-JSGCOSHPSA-N 298.390 3.341 70 20 CGID C[C@H](N[C@H]1CCCSC1)c1ccc(F)cc1N(C)C 159622932 LIWNNUSKPUBIRU-AAEUAGOBSA-N 282.428 3.438 70 20 CGID C[C@H](O)CN(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 159534772 WHCVEOSQIURADE-IUCAKERBSA-N 262.180 3.367 70 20 CGID Cc1ccc(CNc2cccnc2OC(C)C)cn1 159570443 FLHCGIOSDGWUKK-UHFFFAOYSA-N 257.337 3.184 70 20 CGID CCCn1nccc1CNCCSc1ccccc1 160105597 CGKWEUGCVWNJPN-UHFFFAOYSA-N 275.421 3.175 70 20 CGID Cc1ccc(C2CC(N[C@@H]3CCN4CCCC[C@@H]34)C2)cc1 217691604 PNCSVKYGZHFYCK-GMNCBBECSA-N 284.447 3.457 70 20 CGID Cc1occc1C(=O)N[C@H](C)CC(=O)c1cccs1 160870412 QYNFXDIVHJFUGI-SECBINFHSA-N 277.345 3.041 70 20 CGID CC[C@](C)(O)CN1C[C@H](c2ccc(F)cc2)C[C@@H]1C 161176246 UTBYTFMAHIIESJ-BJJXKVORSA-N 265.372 3.165 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1c(C)noc1C 161244204 JZYBEMURUIQGEO-QWHCGFSZSA-N 264.369 3.332 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cccc(C)n1 161284556 CQPXIRVDYCVSRR-ZFWWWQNUSA-N 260.381 3.431 70 20 CGID Cc1ccc2cc(C(=O)N[C@H](C)C[C@@H]3CCCO3)ccc2n1 161410760 PRRBSIGBBCHKNI-CJNGLKHVSA-N 298.386 3.231 70 20 CGID OCC1(CN[C@@H](c2ccccc2)C(F)(F)F)CCCC1 160148975 UGPJOQARXMCKJR-ZDUSSCGKSA-N 287.325 3.432 70 20 CGID O=C1CN(Cc2ccccc2)[C@H](c2coc3ccccc23)N1 160313309 FLMIDIVXESSYSF-GOSISDBHSA-N 292.338 3.063 70 20 CGID CC[C@@H](NCCCCN1CCC[C@@H]1CO)c1cccs1 160700204 RKQRDFQHVOYMEA-HUUCEWRRSA-N 296.480 3.026 70 20 CGID Cn1nccc1CN1CCC[C@H]1c1nc2ccccc2s1 160712879 VNYHIYVKVMRBHL-AWEZNQCLSA-N 298.415 3.367 70 20 CGID COc1ccc2c(c1)[C@@H](N[C@H](CCO)c1ccccc1)CC2 160987229 QMTQHDGIGLDLHI-MOPGFXCFSA-N 297.398 3.396 70 20 CGID CCOC(=O)[C@@H](CC)Sc1nc(C(C)(C)C)ns1 159799826 FHVDRRKEDRBZOH-MRVPVSSYSA-N 288.438 3.269 70 20 CGID O=C1[C@@H](Sc2cccs2)CCCN1CC(F)(F)F 159597083 NOWPAJNWEORRGI-QMMMGPOBSA-N 295.351 3.394 70 20 CGID Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159476453 RKYRNDDVDVYYLP-XHSDSOJGSA-N 257.377 3.042 70 20 CGID CCC[C@@H](C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160475681 DJQFEOOUMJQFCC-ZIAGYGMSSA-N 267.413 3.421 70 20 CGID COc1ccc([C@@H](C)NC(=O)NCC2CCCC2)cc1 217565612 OQJYPMQFKZKHEQ-GFCCVEGCSA-N 276.380 3.246 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2ccncc2)n1 159943936 RFIWZJUFGGWZTI-MRXNPFEDSA-N 253.349 3.122 70 20 CGID CCCC[C@@H](CC)CNc1nccn2c(C)nnc12 218048351 OGVXCSUDKBHZAC-GFCCVEGCSA-N 261.373 3.061 70 20 CGID CC(C)NC(=O)CN[C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 161004650 DYOVGCXQOXDATP-BHYGNILZSA-N 288.435 3.073 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CC=CCC2)o1 161215153 SGKAGNAFKXKFPC-DZGCQCFKSA-N 289.375 3.446 70 20 CGID Cc1cccc(C(=O)NCc2nc3ccccc3[nH]2)c1Cl 160384428 YXEKXFWKBOGKDN-UHFFFAOYSA-N 299.761 3.455 70 20 CGID CC(C)(C)SCCCC(=O)Nc1ccc(F)nc1 160398490 SBRQNRAXOOSZBG-UHFFFAOYSA-N 270.373 3.471 70 20 CGID CC1(C)C[C@H](NCc2c[nH]nc2-c2ccccc2)CCO1 160536682 UYLXLRPFAPMPKQ-OAHLLOKOSA-N 285.391 3.124 70 20 CGID Cc1cc(C)c(C(=O)N2CCc3c(F)cccc3C2)o1 160886909 ZFJWIPULEUZUMO-UHFFFAOYSA-N 273.307 3.234 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@@H](C)C1CCC1 159406077 JXVSRFASTARHTL-JTQLQIEISA-N 250.317 3.444 70 20 CGID Cc1ccc(S(=O)(=O)N2CC[C@@H]3CCCC[C@@H]32)s1 159809021 SUOOBKCAXLFDAY-RYUDHWBXSA-N 285.434 3.010 70 20 CGID CCCC1(CNC(=O)NCc2nc(C)cs2)CCC1 159637889 NNHILUMRVKJPGN-UHFFFAOYSA-N 281.425 3.221 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCc1nc2ccccc2s1 159678374 OOBPTTPRNIFGKX-BMIGLBTASA-N 274.389 3.349 70 20 CGID O=C(CCSc1ccncc1)Nc1cccc(F)c1 159893459 GVMAOVPWGFFVNV-UHFFFAOYSA-N 276.336 3.342 70 20 CGID COCCN(C)CCN[C@@H](CC(C)C)c1cccs1 159389393 SXAJBVYUQLPQMK-AWEZNQCLSA-N 284.469 3.003 70 20 CGID OC[C@@H](NCc1cc(F)cc(Cl)c1)c1ccccc1 160935610 NSSSZNNBDOCDQE-OAHLLOKOSA-N 279.742 3.302 70 20 CGID Cc1ccc(NC(=O)NCCc2ccccc2C)cn1 217315751 SUQXKEONFXIIHF-UHFFFAOYSA-N 269.348 3.063 70 20 CGID CC(C)C1CCC(NC(=O)Cc2ccccc2O)CC1 160473678 TYNBIULMSOBMKF-UHFFFAOYSA-N 275.392 3.266 70 20 CGID CC(C)c1ncc(CN[C@H]2CCOC(C)(C)C2)s1 160548036 MIWQHBCTSDGDKF-NSHDSACASA-N 268.426 3.314 70 20 CGID CCCc1ccccc1NCc1nnc2n1CCCC2 217318582 UOIXUHILKOKOCO-UHFFFAOYSA-N 270.380 3.179 70 20 CGID O=C(NCc1ccc2ccccc2c1)[C@@H]1CCCCO1 161032153 CKNWYBGHPSDMJW-INIZCTEOSA-N 269.344 3.025 70 20 CGID COCCN(CC(C)C)C(=O)[C@@H]1C[C@@H]1c1sccc1C 161170924 BGGKANLLTCIEDU-UONOGXRCSA-N 295.448 3.291 70 20 CGID CO[C@H](C(=O)N1c2ccccc2C[C@@H]1C)c1ccccc1 161258443 GWSCDSFBBXAIKO-GUYCJALGSA-N 281.355 3.352 70 20 CGID CC1(NC(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)CCC1 161360944 VSGATXSEWCHORE-CHWSQXEVSA-N 282.428 3.070 70 20 CGID C[C@@H]1CC[C@@H](CC(=O)N[C@@H]2CCOC3(CCCC3)C2)C1 160036199 SLXGXVDORCZXSG-RBSFLKMASA-N 279.424 3.421 70 20 CGID COc1cc(NCc2cnc3ccccc3n2)ccc1F 160142010 URNNTSFCWWRDCT-UHFFFAOYSA-N 283.306 3.390 70 20 CGID Cc1cncc(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160628813 FTQMPYXQANBCQA-LSDHHAIUSA-N 269.348 3.117 70 20 CGID CN(Cc1cccn1C)C(=O)C1C2CC3CC(C2)CC1C3 160853953 KMNHAFJKHVSDOD-UHFFFAOYSA-N 286.419 3.056 70 20 CGID C[C@@H](NCCC(C)(C)O)c1nc(C(C)(C)C)cs1 159838365 XXGUSBPKKPVLFO-SNVBAGLBSA-N 270.442 3.252 70 20 CGID Cc1nc(CC(=O)N2C[C@@H](C)CCC[C@@H]2C)c(C)s1 159490085 QKMUFGRUWJECAQ-QWRGUYRKSA-N 280.437 3.340 70 20 CGID CC(C)CCNC(=O)[C@H](C)N[C@H](C)c1cccc(F)c1F 159509399 MPRBZGALQJZQAV-NEPJUHHUSA-N 298.377 3.166 70 20 CGID Cc1ccc([C@H]2CCCCN2C(=O)CCNC(C)C)cc1 159912913 FPAYNZXLWCHXIE-QGZVFWFLSA-N 288.435 3.437 70 20 CGID Cc1ccc(CN2CCCC2)c(Br)c1 159916344 CUUJQVSIJNZWTE-UHFFFAOYSA-N 254.171 3.353 70 20 CGID C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1C=CCCC1 159790026 HAWSPGXVMSZQNE-HIFRSBDPSA-N 288.391 3.073 70 20 CGID CCN(CCN[C@H](C)c1ccco1)C(=O)OC(C)(C)C 159485404 HBDJSFAKFJEYLR-GFCCVEGCSA-N 282.384 3.187 70 20 CGID C[C@H]1CCC[C@@H]1CC(=O)Nc1ccc(S(=O)(=O)F)cc1 864237657 BUFCLGUDPMGSPL-WDEREUQCSA-N 299.367 3.110 70 20 CGID Cc1cc2cc(NC(=O)N3CCOC4(CCC4)C3)ccc2[nH]1 161318625 YMSHJGQQFGFURI-UHFFFAOYSA-N 299.374 3.263 70 20 CGID Cn1nccc1CSc1cccc(Br)c1 161370014 BYGOOZYWHALSKK-UHFFFAOYSA-N 283.194 3.475 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)NCc1ccc(Cl)cc1 161494437 MCHZGQQANYBBDB-GHMZBOCLSA-N 266.772 3.422 70 20 CGID Cc1ccc(-c2nnc(NC(=O)C[C@@H]3CC[C@@H](C)C3)[nH]2)o1 160188210 IAKMATABNZKXMP-MWLCHTKSSA-N 288.351 3.138 70 20 CGID O=C1CN(Cc2ccccc2)[C@@H](c2coc3ccccc23)N1 160313189 FLMIDIVXESSYSF-SFHVURJKSA-N 292.338 3.063 70 20 CGID CCOc1ccccc1[C@@H](CC)NCc1n[nH]c(CC)n1 160324361 IRTMYPMFLLDPID-CYBMUJFWSA-N 288.395 3.007 70 20 CGID COc1cc(C)c(CN[C@@H]2CCOC(C)(C)C2)cc1OC 160593360 JFHKXBGUDLLMQE-CQSZACIVSA-N 293.407 3.059 70 20 CGID CCOCc1cccc(N[C@H](C)C(=O)OC(C)(C)C)c1 160867374 LCSITRWKNCPSHD-GFCCVEGCSA-N 279.380 3.365 70 20 CGID Cc1cccc(C)c1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 160953853 VINKJGGCBRATLU-HNNXBMFYSA-N 292.423 3.468 70 20 CGID COc1cc(C)nc(Cn2cnc3cc(C)c(C)cc32)c1 160973758 OSSTXTBMFHBKMP-UHFFFAOYSA-N 281.359 3.413 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cccc(-c2nnco2)c1 160990739 RRXJTDQJTOBLMV-SWLSCSKDSA-N 271.320 3.111 70 20 CGID c1coc([C@@H]2CCCCCN2CCn2ccnc2)c1 159836829 QWYOGCGNXHHIQQ-AWEZNQCLSA-N 259.353 3.093 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](COC)C2CC2)C1 159458294 ZGGNZTPAMCPIEG-MJBXVCDLSA-N 257.443 3.065 70 20 CGID C[C@H]1C[C@H](NC(=O)CCc2cncc(F)c2)CC[C@H]1C 159793539 JBCCFVLHEVPWGW-TYNCELHUSA-N 278.371 3.094 70 20 CGID CCCn1nccc1CNc1cnc2ccccc2c1 160030242 XKIUUALJUCXSID-UHFFFAOYSA-N 266.348 3.453 70 20 CGID CCCCn1ncc(NC(=O)N(CC)CC2CC2)c1C 160156920 OWGACDMDIVZLCW-UHFFFAOYSA-N 278.400 3.255 70 20 CGID O=C(NOCc1cccnc1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 161041009 NSBSHOTXLWABEO-BZUAXINKSA-N 288.391 3.236 70 20 CGID CC(C)OC(=O)[C@@H](C)N(C)C(=O)C1CCC(C)(C)CC1 161223327 YPQOGQKFKPRWQC-GFCCVEGCSA-N 283.412 3.001 70 20 CGID CS[C@@H](C)CNC(=O)[C@@H](OC(C)(C)C)c1ccccc1 161311263 TYLGBMJJSAYHDT-JSGCOSHPSA-N 295.448 3.411 70 20 CGID CCCCn1ncc(C(=O)Nc2cc(F)ccc2O)c1C 160007994 GNYYAVXYVDRNNO-UHFFFAOYSA-N 291.326 3.089 70 20 CGID CC(C)CC[C@@H](C)NC[C@](C)(O)c1ccsc1 160044217 VZNINDIATOILJZ-OCCSQVGLSA-N 255.427 3.370 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)C[C@H]1C=CCC1 160103138 AFBPRJVYNKNPGV-SWLSCSKDSA-N 271.360 3.155 70 20 CGID CC(C)Oc1cncc(C(=O)Nc2cc(F)cc(F)c2)c1 160251340 GCGRHLMUARPZKF-UHFFFAOYSA-N 292.285 3.399 70 20 CGID COc1ccc(N(C)C(=O)c2oc(C)nc2C)cc1Cl 160309752 PTFXQHFMSYDNPP-UHFFFAOYSA-N 294.738 3.230 70 20 CGID O=C(Nc1c(F)cccc1F)N[C@H]1CCO[C@H](C2CC2)C1 160999859 ZEOHALRRNQWXSC-GWCFXTLKSA-N 296.317 3.044 70 20 CGID CC[C@H](N[C@H](C)c1cccc(OC(C)C)c1)C(=O)OC 159504166 FZYYFGYYBAVXAR-DOMZBBRYSA-N 279.380 3.076 70 20 CGID COc1cc(N[C@@H](C)c2cn(C)nc2C)ccc1F 160048263 QAJFVCXSPVZTAW-VIFPVBQESA-N 263.316 3.049 70 20 CGID CCCCOCCCN[C@H](C)Cc1ccc(O)cc1 160210313 MTUIQGRSBHEJPS-CQSZACIVSA-N 265.397 3.120 70 20 CGID N[C@@H]1CCCCC[C@@H]1c1nc([C@@H]2CCCCS2)no1 160673962 RFLDSLTWDSXHBD-TUAOUCFPSA-N 281.425 3.403 70 20 CGID CC(NC(=O)CCl)(c1ccccc1)c1ccccc1 59659757 OXSDPKKYPZJMAR-UHFFFAOYSA-N 273.763 3.305 70 20 CGID CCCCn1ncc(Nc2ccc3nccnc3n2)c1C 161123906 LBAZRPMSWSRXAE-UHFFFAOYSA-N 282.351 3.073 70 20 CGID Cn1nccc1COc1cccc(Cl)c1Cl 161204414 REDKZXPXBGEQII-UHFFFAOYSA-N 257.120 3.306 70 20 CGID Cc1ccc(C(=O)N[C@@H](C)CC(C)C)c(Br)n1 161356108 FEQCDPRFXDPPMH-JTQLQIEISA-N 299.212 3.317 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)CCOc1ccccc1F 160236772 TVSCYIWCUOFZBI-LRDDRELGSA-N 279.355 3.099 70 20 CGID CCOCCC1(CNC(=O)N[C@H]2CCCCC2(C)C)CC1 160262935 KMOJRZDZQCTGFG-AWEZNQCLSA-N 296.455 3.461 70 20 CGID Cc1ccc(CCNC(=O)C2CCC(C)(C)CC2)cn1 160268185 ROABMJYKBHFBJQ-UHFFFAOYSA-N 274.408 3.265 70 20 CGID O=C(Cc1ccsc1)N[C@H]1CCOC2(CCCCC2)C1 160280398 HRNCYSUDZBBIQU-AWEZNQCLSA-N 293.432 3.289 70 20 CGID O=C(Oc1ccc(F)cc1)c1csc([C@@H]2CCCO2)n1 160489405 FFTFGYQPDIYBNJ-LBPRGKRZSA-N 293.319 3.353 70 20 CGID Cc1ccc(O)c(C(=O)NCc2nc(C(C)C)cs2)c1 160579622 IDENYOUDIHLFNJ-UHFFFAOYSA-N 290.388 3.211 70 20 CGID CC1(C)C[C@@H]1C(=O)N[C@H]1CCc2c(Cl)cccc21 160869287 UOCLCKYLIFJJRI-YPMHNXCESA-N 263.768 3.490 70 20 CGID CC(C)CSCCCNC(=O)c1noc2c1CCCC2 160877200 VGVFCOZHWDEGDV-UHFFFAOYSA-N 296.436 3.063 70 20 CGID Cn1ccnc1COc1c(Cl)cccc1Cl 160976149 VYGWGGUKRXKXSM-UHFFFAOYSA-N 257.120 3.306 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)C1CCCCC1 159533843 WQWKYNPXHBWWEC-AWEZNQCLSA-N 265.397 3.175 70 20 CGID Cc1cccc([C@H](C)C(=O)N[C@H](C)CN2CCCCC2)c1 159755037 ZTKPQZHOAUBXHY-CVEARBPZSA-N 288.435 3.089 70 20 CGID CCO[C@H]1C[C@H](NCc2cccc(F)c2F)C1(C)C 217901748 GODVSDLYNRIAQT-STQMWFEESA-N 269.335 3.258 70 20 CGID CCO[C@@H]1C[C@H](NCc2cccc(F)c2F)C1(C)C 217901650 GODVSDLYNRIAQT-QWHCGFSZSA-N 269.335 3.258 70 20 CGID CC(C)N(CCNCc1cccc2cc[nH]c12)C(C)C 218071787 ZIDIJPUCCYINCA-UHFFFAOYSA-N 273.424 3.376 70 20 CGID Cc1c(Br)cccc1Cn1c(C)csc1=O 160130707 QPWJMCQMODIGNA-UHFFFAOYSA-N 298.205 3.337 70 20 CGID CCc1ncnc(N[C@@H]2CCC[C@H](SC)C2)c1F 218024206 OFOMQWCBJQQRGH-ZJUUUORDSA-N 269.389 3.264 70 20 CGID CCc1ccccc1NC(=O)NCCCC(=O)OC(C)C 161111676 HHWSNHQJTHTZCX-UHFFFAOYSA-N 292.379 3.102 70 20 CGID CN(C[C@H]1CCOC1)C(=O)C[C@H]1CCCCC1(C)C 161395785 JYYFIFZYSPOXPH-ZIAGYGMSSA-N 267.413 3.088 70 20 CGID CCCNC(=O)CN[C@@H](CC)c1cccc(Cl)c1F 161503925 NIRKZEURFQPIFK-LBPRGKRZSA-N 286.778 3.046 70 20 CGID Cc1cccc(NC(=O)c2ccc(C(C)C)nc2)c1O 160022455 QTLKYGTYHIHAOI-UHFFFAOYSA-N 270.332 3.471 70 20 CGID COc1cc(N[C@@H]2CCOC(C)(C)C2)ccc1F 160069993 SKNDAMSEBGJXHV-LLVKDONJSA-N 253.317 3.204 70 20 CGID CN(C(=O)C1CCCCCC1)c1ccc2c(c1)OCO2 160220980 JWROHOARKXSSOV-UHFFFAOYSA-N 275.348 3.349 70 20 CGID C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1cccc(F)n1 160221936 FOWFDNXJRLWPLU-ZFWWWQNUSA-N 285.366 3.153 70 20 CGID CC(C)C1CCC(NC(=O)NCc2ncccc2F)CC1 160537929 UCAXTGATSZHJSX-UHFFFAOYSA-N 293.386 3.235 70 20 CGID CC(C)COCCN[C@H](Cc1ccccc1)C1CC1 160664152 ONWLISJZBZULCR-QGZVFWFLSA-N 261.409 3.270 70 20 CGID COCCC1(CNC(=O)N2[C@H]3CCCC[C@H]3C[C@H]2C)CC1 160999621 UKUILHQBCKWUSD-ILXRZTDVSA-N 294.439 3.166 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(C)n(C(C)(C)C)n1 159810860 WTTMREVVCJEQEC-STQMWFEESA-N 277.412 3.255 70 20 CGID C[C@@H](OCC1CC1)C(=O)N[C@H]1CCCc2sccc21 159839457 JUBNGAIVMKYORR-MFKMUULPSA-N 279.405 3.057 70 20 CGID C[C@@H]1CC(NC(=O)Nc2cccc(F)c2F)C[C@@H](C)O1 159984047 UIOCDHJOXMZAGE-RKDXNWHRSA-N 284.306 3.042 70 20 CGID Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(CC1CC1)CC1CC1 159991116 MECQOSRXCRAHIK-LLVKDONJSA-N 289.423 3.169 70 20 CGID c1ccc(NCCc2nc([C@H]3CCCS3)no2)cc1 160625795 MSCDJLWSVUQQHW-GFCCVEGCSA-N 275.377 3.292 70 20 CGID CC(C)CCOc1ccc(CS(=O)(=O)Cl)cc1 390582574 JUNZTDQLEPFAPW-UHFFFAOYSA-N 276.785 3.180 70 20 CGID CC[C@@H](CNC(=O)NOCc1cccnc1)c1ccccc1 161019863 XANJBQXBSFQXTD-HNNXBMFYSA-N 299.374 3.006 70 20 CGID O=C(CCc1ccccc1)N1CCc2c(F)cccc2C1 161043054 OIDNTBWBTHKXFG-UHFFFAOYSA-N 283.346 3.343 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1 161059299 ZPZBBNCQULBWTA-SWLSCSKDSA-N 292.354 3.213 70 20 CGID Cc1ccc(C(=O)N2CCc3c(F)cccc3C2)s1 161083557 LMELPPMJKWVCIU-UHFFFAOYSA-N 275.348 3.394 70 20 CGID CN(C(=O)Nc1ccc(Cl)c(F)c1)[C@@H]1CCSC1 161144105 UDQJFKPYHGGXJL-SECBINFHSA-N 288.775 3.448 70 20 CGID COc1ccc(CN(C)Cc2cccn2C)cc1Cl 161246048 SHGGPNVGJRDWFP-UHFFFAOYSA-N 278.783 3.319 70 20 CGID COc1ccc(NC(=O)C[C@H]2CC[C@H](C)C2)cc1N 161249068 POBFBBAMAOZFLM-QWRGUYRKSA-N 262.353 3.042 70 20 CGID C[C@H](NCC1(CO)CCCC1)c1ccccc1OC(F)F 160083582 ZCINWXLAWHQOTE-LBPRGKRZSA-N 299.361 3.491 70 20 CGID c1ccc2c(SCCn3ccnc3)ccnc2c1 160126186 VIORFIAMFCYGFQ-UHFFFAOYSA-N 255.346 3.224 70 20 CGID COCCC1(C(=O)Nc2ccc(C)cc2O)CCCC1 160400783 MIELGFHWOCEEHR-UHFFFAOYSA-N 277.364 3.236 70 20 CGID CCCCC(=O)N[C@@H]1CCOC2(CCCCC2)C1 160559210 CDWLHURQPNNQRA-CYBMUJFWSA-N 253.386 3.175 70 20 CGID CC(C)[C@@H](C)NC[C@H](C)N1CCc2ccccc2C1 159801203 AIEPUUANOAXRBC-LSDHHAIUSA-N 260.425 3.067 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cnn(C(C)(C)C)c1C 159643671 VCKIVHOYGBTHJE-OCCSQVGLSA-N 277.412 3.255 70 20 CGID Cc1cnc(C)c(N[C@H]2CCCc3cc(N)ccc32)n1 159505484 UQXAVEQQDOZCJD-HNNXBMFYSA-N 268.364 3.165 70 20 CGID COC[C@H](C)NCc1cc(C(F)(F)F)ccc1Cl 159871243 AUEXADVRKQZKJI-QMMMGPOBSA-N 281.705 3.483 70 20 CGID C[C@H](CCC(C)(C)C)NC(=O)N(C)Cc1cccn1C 161071646 VHNFZCATPXHLGV-CYBMUJFWSA-N 279.428 3.381 70 20 CGID CC[C@H](C)OCC(=O)N1CCC[C@H]1c1cccc(C)c1 160212416 DBCYDINVIXNZOK-HOCLYGCPSA-N 275.392 3.474 70 20 CGID CCc1nc(CN[C@@H](C)c2cccc3ccccc23)n[nH]1 160272604 XWXGZKUGVMCHAH-LBPRGKRZSA-N 280.375 3.371 70 20 CGID CSC[C@H](CCO)N[C@@H](C)c1cccc(Cl)c1 160282253 ZFVYNGHDKQWETE-GWCFXTLKSA-N 273.829 3.105 70 20 CGID O=C(c1ccccc1F)N1CC=C(C(F)(F)F)CC1 160582298 HFOADQMVAPPULU-UHFFFAOYSA-N 273.229 3.160 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(N2CCCCC2)cn1 160835166 FCUZUCQDGSFVOB-GFCCVEGCSA-N 293.436 3.152 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@H]1CCOC(C)(C)C1 160837445 QLJVKXSSLDAGBW-LBPRGKRZSA-N 280.343 3.213 70 20 CGID Cc1nc2ccccn2c1CN(C)CCc1cccs1 160852316 IDAOGXNUXQBDPU-UHFFFAOYSA-N 285.416 3.379 70 20 CGID Cc1ccc(C)c(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1 160915717 HSFLJYTWQGICTA-GDBMZVCRSA-N 288.391 3.383 70 20 CGID CCCC[C@H](CC)CNC(=O)NOCc1cccnc1 160976795 DNZQQVFCHZNLDY-ZDUSSCGKSA-N 279.384 3.029 70 20 CGID CC(C)CCCNC(=O)NCc1nc(C2CC2)cs1 159615633 DMUTUJBXUIQOQD-UHFFFAOYSA-N 281.425 3.256 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@H]1C[C@@H]1C1CC1 159816107 CQRFHOHQMSLUSE-FRRDWIJNSA-N 261.390 3.288 70 20 CGID C[C@@H]1CN(c2nc(C(C)(C)C)ns2)C[C@@H](C)S1 159695637 WTCLWZNHGOXGAJ-RKDXNWHRSA-N 271.455 3.166 70 20 CGID Cc1ccccc1CNC(=O)N1CC[C@@H](C)[C@@H](C)C1 159890763 TXKSLSPVOFRITM-OCCSQVGLSA-N 260.381 3.183 70 20 CGID Cc1nccc(NC(=O)N[C@@H](C)c2cccnc2)c1Cl 159568122 RCENMGLTBTVGJZ-VIFPVBQESA-N 290.754 3.321 70 20 CGID COc1ccc(N[C@@H]2C[C@@H](C)N(C)C[C@@H]2C)cc1Cl 217908581 AGBJNBBLWXURNR-MISXGVKJSA-N 282.815 3.489 70 20 CGID C[C@@H]1CCC[C@@H](CNCc2cn3ccccc3n2)C1 218237361 VOCDKRXHKMFZDT-ZIAGYGMSSA-N 257.381 3.250 70 20 CGID CC[C@@H]1CCCC[C@H]1NCc1ccc(N(C)C)nc1 159852239 IDJSBQKXACYLBQ-HUUCEWRRSA-N 261.413 3.206 70 20 CGID CC[C@@H](NCc1cccc(OC)n1)c1ccc(F)cc1 160848031 BBHDIYNUYBFODU-OAHLLOKOSA-N 274.339 3.470 70 20 CGID Cc1nn(C)c(C)c1CNCc1cc(F)cc(Cl)c1 160959150 COKNABYBYCVFKU-UHFFFAOYSA-N 281.762 3.119 70 20 CGID O=C(Nc1ncccc1O)C1(c2ccccc2)CCCC1 218560128 NUGMQALILANKKI-UHFFFAOYSA-N 282.343 3.238 70 20 CGID Cc1cc(C)nc(NC(=O)/C=C\c2ccsc2)c1 216748103 XJJSACBUEADJIQ-ARJAWSKDSA-N 258.346 3.412 70 20 CGID Cc1cc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)nc(C)n1 160212676 SJPKGPYFKXHQQB-SUMWQHHRSA-N 296.418 3.026 70 20 CGID C[C@@H](NC(=O)N1CCCCCC1)c1ccsc1 160525196 FHLQWGGIQBNWGF-LLVKDONJSA-N 252.383 3.395 70 20 CGID CCCCO[C@H](C)C(=O)N[C@@H](CC)c1c(C)noc1C 160755346 PCLJUVPPJFQADR-OLZOCXBDSA-N 282.384 3.064 70 20 CGID CC[C@@H](C(=O)N1CCOC2(CCC2)C1)c1ccc(F)cc1 161455761 FBNJZWLJNTYZCR-OAHLLOKOSA-N 291.366 3.101 70 20 CGID CC(C)n1nccc1C(=O)NCC1(c2ccccc2)CCC1 161466800 PIZXWBLJEOLIHI-UHFFFAOYSA-N 297.402 3.316 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1ccoc1C 160143578 SBHAHCMMTJCHTR-AWEZNQCLSA-N 271.316 3.014 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)CCOc1ccc(F)cc1 160233809 GUQKDJPFDZTQMM-GOEBONIOSA-N 279.355 3.099 70 20 CGID CCCCOCCCNc1nc(C(C)(C)C)ns1 160357256 ZRYWYNIDXRRWDQ-UHFFFAOYSA-N 271.430 3.454 70 20 CGID Cc1c(C(=O)N2CC[C@@H]3CCCC[C@@H]32)cnn1CC(C)C 160619297 DBRQJCNESPGAGA-HOCLYGCPSA-N 289.423 3.252 70 20 CGID Cc1cc(N[C@H]2C=CCCC2)nc(-c2ccncc2)n1 160712862 XSHYRGXMYXXASB-AWEZNQCLSA-N 266.348 3.368 70 20 CGID O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)NCC1(C2CC2)CC1 160728390 UHIKYQWYQFOKPD-ZACQAIPSSA-N 296.414 3.062 70 20 CGID COCC(=O)O[C@@H](C)c1ccc(F)c(C(F)(F)F)c1 159468143 ZBLFLRSQCVXJFB-ZETCQYMHSA-N 280.217 3.095 70 20 CGID CC(C)n1nccc1C(=O)N1C[C@H](C)CCC[C@@H]1C 159490476 USJSJWSIRCVLEY-OLZOCXBDSA-N 263.385 3.115 70 20 CGID COCc1ccc(CNc2ccc(OC)cc2C)o1 159497643 UEQSIWHSHGJQHO-UHFFFAOYSA-N 261.321 3.355 70 20 CGID O=C(OC1CCCC1)c1ccc(OC(F)F)cc1 218474947 QKWISHCDDKZGPC-UHFFFAOYSA-N 256.248 3.387 70 20 CGID CC(C)Sc1ccccc1NC(=O)c1cc[nH]c(=O)c1 160891748 BYCBSWNMDLKWRK-UHFFFAOYSA-N 288.372 3.128 70 20 CGID CNC(=O)C(C)(C)CNc1ccnc2ccc(Cl)cc12 161076787 KCNDQJFCSKPSMS-UHFFFAOYSA-N 291.782 3.072 70 20 CGID COCc1cccc(C(=O)N2CCc3c(F)cccc3C2)c1 161085238 YWTFWEHVQCRJBS-UHFFFAOYSA-N 299.345 3.171 70 20 CGID CC1(NC(=O)NCC(C)(C)c2cccs2)CCC1 161253506 AZYYXYBYFSXNSJ-UHFFFAOYSA-N 266.410 3.268 70 20 CGID CC[C@H](NC(=O)Cc1ccccc1C)c1c(C)noc1C 160398422 XRBYTAGTOSNRMX-HNNXBMFYSA-N 286.375 3.410 70 20 CGID CCOc1cncc(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160547871 BWPXWXYUXBCMOV-CABCVRRESA-N 299.374 3.208 70 20 CGID CC(C)CC(CC(C)C)NC(=O)N(C)C[C@@H]1CCC[C@@H]1O 160761704 WIQGTOGWDRHVAQ-HOCLYGCPSA-N 298.471 3.250 70 20 CGID COc1ccc(C(C)(C)C(=O)Nc2cccc(F)n2)cc1 160944112 HLMMHMZMTOQNQF-UHFFFAOYSA-N 288.322 3.146 70 20 CGID Cc1cc(C(=O)N2C[C@@H](C)CSc3ccccc32)no1 159485357 SMDOKRNLPVPEHX-SNVBAGLBSA-N 288.372 3.372 70 20 CGID CCOc1ccc([C@@H](C)N[C@H](C)[C@@H]2CCOC2)cc1OC 159946163 CBCAGXTXMOBTMI-UMVBOHGHSA-N 293.407 3.170 70 20 CGID CSC[C@@](C)(O)CNCc1ccc2ccccc2c1 217847486 JSVQKDWKZOYLFG-INIZCTEOSA-N 275.417 3.043 70 20 CGID O=S(=O)(Cl)CCCCCOC1CCCCC1 113155851 GATPQBXWGJQCDO-UHFFFAOYSA-N 268.806 3.075 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1cccc(C)c1 161068206 KDUIJMQZMRVDTK-SFHVURJKSA-N 263.362 3.162 70 20 CGID CC(=O)NC1CCC(Nc2cccc(C)c2C)CC1 161077066 UBBZCUVFOPNKPK-UHFFFAOYSA-N 260.381 3.163 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CCCCCCC1 161219687 UZRALQIFHVCUOB-UHFFFAOYSA-N 299.374 3.451 70 20 CGID CC(C)COc1cccc(NC(=O)N[C@]2(C)CCOC2)c1 161356755 SYXXWIMOOWTVMF-MRXNPFEDSA-N 292.379 3.022 70 20 CGID CC[C@H](NC(=O)C1=C(C)OCCC1)c1ccc(OC)cc1 161416775 DHHSXASMTVQMEZ-INIZCTEOSA-N 289.375 3.347 70 20 CGID CCCN(C(=O)CC(C)C)[C@H](C)C(=O)Nc1ccccc1 161445116 YHDIAZUSVNQOEG-CQSZACIVSA-N 290.407 3.298 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)CCCCCCN)C1 161471587 XZQKVSJQVPEIFS-HNNXBMFYSA-N 268.445 3.180 70 20 CGID CCOCCC1(CNC(=O)N2C[C@H](C)CCC[C@@H]2C)CC1 161508969 ZROSPHIUZXLLFH-CABCVRRESA-N 296.455 3.413 70 20 CGID CC(C)c1cc(C(=O)N[C@H]2CCCc3sccc32)n[nH]1 160050711 WELZWXKLINKYOL-NSHDSACASA-N 289.404 3.402 70 20 CGID Cc1noc(C)c1CCSCc1c(C)noc1C 160065413 KGZJQABZSACICA-UHFFFAOYSA-N 266.366 3.372 70 20 CGID CC(=O)Nc1cccc(NC(=O)N[C@H](C)C2CCC2)c1C 160370050 GKNKYDNBKRBYRS-LLVKDONJSA-N 289.379 3.264 70 20 CGID CCc1ccc([C@@H](C)N[C@@H](CCO)CSC)s1 160409188 LQIXCQWRSPEUQE-MNOVXSKESA-N 273.467 3.075 70 20 CGID C[C@@H](CC(=O)N[C@H]1CCCSC1)c1ccc(F)cc1F 160829070 ABTXYFURVHBOSE-JQWIXIFHSA-N 299.386 3.470 70 20 CGID Cc1cccc(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)n1 160877360 XBWZDEXLQGEUGT-CQSZACIVSA-N 288.391 3.002 70 20 CGID C[C@H](Sc1ccccc1)C(=O)N(C)Cc1cccn1C 160941314 YLJCYEAWUACPDD-ZDUSSCGKSA-N 288.416 3.164 70 20 CGID Cc1nnc(CSc2ccccc2Cl)n1C 160948083 NELIWCQMNFEXPQ-UHFFFAOYSA-N 253.758 3.069 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@@H]1c1ccc(F)cc1F 159869001 OAXMTHGDHAQNBQ-KGLIPLIRSA-N 291.341 3.375 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N1C[C@@H](c2ccccc2)C[C@H]1C 159789186 WUHDSNIWZKACBM-JSSFPYSZSA-N 299.414 3.396 70 20 CGID CC[C@H](NC(=O)c1ccc(Cl)cc1C)c1ncc[nH]1 218079890 RGPZGWKDOWYZEX-LBPRGKRZSA-N 277.755 3.253 70 20 CGID CC[C@@H](C)c1ccc(OCC(=O)NCC(C)C)cc1 217343146 NXNQBFBBIFHNEQ-CYBMUJFWSA-N 263.381 3.351 70 20 CGID COc1cc(NCCCOCC(F)(F)F)ccc1F 160245026 DJMAGKJJDNQTGS-UHFFFAOYSA-N 281.249 3.215 70 20 CGID O=C(NC[C@H]1CCCN1c1ccccc1)c1ccccc1 217806705 UDROUSUZFHYRFX-QGZVFWFLSA-N 280.371 3.085 70 20 CGID Cc1nc(NC(=O)CCC2CCC2)cc(C2CC2)n1 160146259 QOCTZBHQRGGGJY-UHFFFAOYSA-N 259.353 3.181 70 20 CGID CC(C)[C@@H](CCc1ccccc1)NC1CCN(C)CC1 161506595 DTNXRCCOENHOBF-GOSISDBHSA-N 274.452 3.328 70 20 CGID O=C(NCC(F)(F)F)N[C@H]1CCCc2cc(F)ccc21 160046449 IHIFAJNVJIEREV-NSHDSACASA-N 290.260 3.065 70 20 CGID CN1CCC(Oc2ccc(NCc3ccccc3)cn2)CC1 160081496 SNJIVFOPEPJDIO-UHFFFAOYSA-N 297.402 3.167 70 20 CGID C[C@@H](C(=O)N[C@@H]1CCc2c(O)cccc21)c1cccs1 160234610 SGFGLJPMHWHCAQ-ZWNOBZJWSA-N 287.384 3.361 70 20 CGID O=C(C[C@@H]1CCCCO1)N[C@@H]1CCCc2sccc21 160269338 XIYXGCFJXPTOFT-WCQYABFASA-N 279.405 3.201 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@H]2C=CCCC2)n1 160326478 HAEDUVGSQOXVQG-ZDUSSCGKSA-N 276.384 3.159 70 20 CGID CS[C@@H](C)CC(=O)NCc1ccccc1OC(C)C 160619447 RQWCSRWWQAQSHI-LBPRGKRZSA-N 281.421 3.232 70 20 CGID CCOCCC1(CNC(=O)[C@@H](C)c2cccc(C)c2)CC1 159437402 FWYOXCBSTAXRKD-HNNXBMFYSA-N 289.419 3.422 70 20 CGID CSCCNC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 159456808 GJGKXHUWUJOWJU-YNEHKIRRSA-N 255.427 3.072 70 20 CGID Cc1cc(C)c(C(=O)NCCCOC2CCCCC2)[nH]1 159503397 FOLFPXIZYQVDNC-UHFFFAOYSA-N 278.396 3.101 70 20 CGID CC[C@@H](NC(=O)Nc1ccc2c(c1)CCC2)[C@@H]1CCCO1 159510769 RHPIJJXAHCXAFA-CVEARBPZSA-N 288.391 3.254 70 20 CGID CC[C@@H](OC1CCCCC1)C(=O)NCCCOCC(C)C 159712992 QALXKASSSZDTFB-MRXNPFEDSA-N 299.455 3.293 70 20 CGID Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)no1 159918614 BLYIEQLPNFMPIC-VHSXEESVSA-N 262.334 3.095 70 20 CGID CCc1ccc2nc(NC(=O)[C@H]3CCCCO3)sc2c1 159788549 RXULJMOIFBZHIT-GFCCVEGCSA-N 290.388 3.366 70 20 CGID CC(C)(C)NC(=O)CN[C@H](c1cccs1)C1CCCC1 159876553 AXZXAGGRECDMNQ-HNNXBMFYSA-N 294.464 3.484 70 20 CGID CN(Cc1csc(C2CC2)n1)C[C@@H]1CCCCO1 161450334 NRQSUWFBJAZSRV-ZDUSSCGKSA-N 266.410 3.021 70 20 CGID Cc1cc(O)ccc1NC(=O)NCCc1ccc(F)cc1 217521671 GAOKLCUAOZPEAF-UHFFFAOYSA-N 288.322 3.204 70 20 CGID CCn1nc(C)c(CN(C)Cc2ccc(C)cc2)c1C 160636873 DVNCDLYGCVUAHC-UHFFFAOYSA-N 271.408 3.460 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(C)o2)o1 161214164 OURYEZCHGOSQCH-ZDUSSCGKSA-N 289.331 3.305 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)N(C)c2ccc3c(c2)OCO3)C1 160089561 AOZMXTSSQBVREX-VXGBXAGGSA-N 275.348 3.204 70 20 CGID CC[C@H]1CCCC[C@H]1NC(=O)Cc1c(C)noc1Cl 160103031 FFCKKOKJFRFYLT-CMPLNLGQSA-N 284.787 3.264 70 20 CGID CC(C)=C[C@H]1[C@H](C(=O)N(C)Cc2cccn2C)C1(C)C 160454545 MZAHVYGMNDFBBU-LSDHHAIUSA-N 274.408 3.222 70 20 CGID COC(=O)CCCC(=O)N1CCC[C@H](C)c2ccccc21 160518898 XUKJUPTYSIMDQF-ZDUSSCGKSA-N 289.375 3.260 70 20 CGID CS[C@H](C)CC(=O)N[C@H](C)Cc1ccccc1F 160849187 PPAFXEWMZAUKBA-GHMZBOCLSA-N 269.385 3.015 70 20 CGID CS[C@@H](C)CC(=O)N[C@H](C)Cc1ccccc1F 160849428 PPAFXEWMZAUKBA-MNOVXSKESA-N 269.385 3.015 70 20 CGID CC[C@@H](C)CN(CC)C(=O)Nc1cc(C(=O)OC)cs1 160967954 AJMXTDKLNACHGW-SNVBAGLBSA-N 298.408 3.435 70 20 CGID CCC[C@@H](C(=O)N[C@H](CCO)c1ccccc1)C(C)C 159516779 XRNSKETUQJAEQZ-HZPDHXFCSA-N 277.408 3.299 70 20 CGID COCCC1(CNc2nc(C(C)(C)C)ns2)CCC1 159970052 IZGVODBSGONOJL-UHFFFAOYSA-N 283.441 3.454 70 20 CGID c1cc(SCCCOc2ccc3c(c2)OCO3)ccn1 159975276 NXYZFDMMNBXPTM-UHFFFAOYSA-N 289.356 3.372 70 20 CGID COc1ccccc1N(C)C(=O)c1cccc(C)c1F 161468082 KMIHHHQVRAVDRZ-UHFFFAOYSA-N 273.307 3.419 70 20 CGID CCCCOCCN1CCC[C@H]1c1cccc(C)n1 159735806 LVDZIMGZUHMAIG-INIZCTEOSA-N 262.397 3.344 70 20 CGID Cc1nnc(CS[C@H](C)c2c(F)cccc2F)n1C 161037306 ZVUKJJKAQBZOFB-MRVPVSSYSA-N 283.347 3.396 70 20 CGID Cc1cccnc1[C@@H](NC(=O)NC1(C)CCC1)C(C)C 161292292 HILHCISHECWNLG-ZDUSSCGKSA-N 275.396 3.329 70 20 CGID C[C@@H](CC(=O)N[C@H]1CCCc2occc21)c1ccncc1 160531602 GPTVZYXKXAYRSD-WFASDCNBSA-N 284.359 3.362 70 20 CGID COc1cc(CN[C@H]2CCOC(C)(C)C2)ccc1SC 160627707 PDIZQXUWPPBOIL-ZDUSSCGKSA-N 295.448 3.464 70 20 CGID C[C@@H](N[C@H](CN1CCCC1=O)c1ccccc1)c1ccco1 160758677 AALOQMFCQJMTIZ-GDBMZVCRSA-N 298.386 3.294 70 20 CGID Cc1cccc(C(=O)N2CCC(OC(C)(C)C)CC2)c1O 160918268 NMJJIVJMIDBTOL-UHFFFAOYSA-N 291.391 3.120 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cccc(F)c1 160964084 ZRMDGZDGZGPFST-HNNXBMFYSA-N 291.366 3.437 70 20 CGID C[C@H](Nc1nc(C(C)(C)C)ns1)C(C)(C)CN(C)C 159635656 PREBWVITUDLKNO-JTQLQIEISA-N 284.473 3.224 70 20 CGID Cc1cccc(OC[C@@H](C)NC(=O)NC2(C)CCC2)c1 159892798 GXQJLRIKGGNYCS-CYBMUJFWSA-N 276.380 3.004 70 20 CGID Cc1cc(C)cc(CCN[C@H](C)C2CCN(C)CC2)c1 159515006 JUWOIIGOKRTLAY-MRXNPFEDSA-N 274.452 3.166 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)C1CCCCC1 159533717 WQWKYNPXHBWWEC-CQSZACIVSA-N 265.397 3.175 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NCCCn1ccnc1)C2 218511292 OXYVJONQCHMAAX-DZKIICNBSA-N 261.413 3.078 70 20 CGID NCC1(Cc2nc([C@@H]3CCCS3)no2)CCCCC1 160615123 LFYLZDKDAXPLJH-NSHDSACASA-N 281.425 3.089 70 20 CGID C[C@H]1CC=CC[C@H]1COC(=O)Cc1ccsc1 218498836 BOZYGRWRYXHANC-AAEUAGOBSA-N 250.363 3.436 70 20 CGID CN(c1ccccc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 218259304 CLDQRAFQFVRRFB-AWEZNQCLSA-N 276.380 3.132 70 20 CGID COc1ccc(NC(=O)C=C2CCC(C)CC2)cc1N 161238407 ILSDNSSPEACAHV-UHFFFAOYSA-N 274.364 3.352 70 20 CGID CC(C)C1CCN(C(=O)[C@@H](C)[C@@H](N)c2ccccc2)CC1 161269053 FWMDAZDAAJMDJR-WMLDXEAASA-N 288.435 3.217 70 20 CGID CC[C@@H](C)[C@H](C(=O)N1CCC(C)(O)CC1)c1ccccc1 161304773 BQCXNROEXQDWES-ZBFHGGJFSA-N 289.419 3.190 70 20 CGID CN(C)Cc1ccc(C(=O)N2CCC[C@H]2c2ccc[nH]2)cc1 160064857 ZDDONPQMNOJSEI-KRWDZBQOSA-N 297.402 3.054 70 20 CGID C[C@H]1CCC[C@H](C(=O)N(C)c2ccc3c(c2)OCO3)C1 160089418 AOZMXTSSQBVREX-RYUDHWBXSA-N 275.348 3.204 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@@H]1c1c(F)cccc1F 160090414 OYMHLNMUUIRKTP-NWDGAFQWSA-N 291.341 3.375 70 20 CGID CCC1(CC)[C@@H](N[C@@H](C)c2cccnc2)C[C@@H]1OC 160109861 PYSKPZJXSUEWBK-QEJZJMRPSA-N 262.397 3.326 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCCCN(C)Cc1ccccc1 160166192 NBCCMSJCMOHLHE-WMZOPIPTSA-N 288.435 3.061 70 20 CGID C[C@H](CO)N(C)C(=O)c1ccc(C2CCCCC2)cc1 160542668 OJYPNTVYMBJSAE-CYBMUJFWSA-N 275.392 3.187 70 20 CGID Cc1csc(CNC(=O)[C@@H]2C[C@@H]2c2sccc2C)n1 160618337 PSHNPCHFWILVPO-WDEREUQCSA-N 292.429 3.241 70 20 CGID CCN(Cc1ccoc1)C(=O)COc1cc(C)ccc1F 160647425 PKDPZPMTUSTGDM-UHFFFAOYSA-N 291.322 3.155 70 20 CGID C[C@H]1COc2ccccc2N1C(=O)C[C@@H](C)c1ccncc1 160906484 PQZUWYSJIFRWFS-KGLIPLIRSA-N 296.370 3.389 70 20 CGID Cc1cc(SCc2nnc(C)n2C)nc2ccccc12 160964620 QXRYYZXCPPBNEL-UHFFFAOYSA-N 284.388 3.272 70 20 CGID CCc1ccc(NC(=O)N[C@H](CC)[C@H]2CCCO2)cc1 159410095 VHIJLEWGQVLHOS-HUUCEWRRSA-N 276.380 3.328 70 20 CGID CCCCn1ncc(C(=O)NCCCc2ccccc2)c1C 159560473 CDANUAXKIBGVJR-UHFFFAOYSA-N 299.418 3.354 70 20 CGID Cc1cc(C)c([C@H](C)N2CCC[C@@H](CN)C2)c(C)c1 217510130 QRRSULBZKRZEJD-HOTGVXAUSA-N 260.425 3.344 70 20 CGID O=C(NC[C@@H]1CCCN1c1ccccc1)c1ccccc1F 217807554 WSCNAJOYMGOJPA-HNNXBMFYSA-N 298.361 3.225 70 20 CGID CC[C@H](C)NC(=O)c1ccccc1OCc1cscn1 161054548 RWNRQYPTJKOIDE-NSHDSACASA-N 290.388 3.250 70 20 CGID CCCC[C@@H](CC)CC(=O)N1CCC(CNCC)CC1 161055248 IZMIXVURCHXZBV-OAHLLOKOSA-N 282.472 3.441 70 20 CGID CCOCCC1(CNC(=O)N2CC[C@@H](C)C[C@H]2C)CC1 161424845 BMUUUSDWAQDWAP-ZIAGYGMSSA-N 282.428 3.023 70 20 CGID CCCCNC(=O)c1ccc(CN[C@H](CC)C2CC2)cc1 160117721 NLBDISMVZFUHGL-QGZVFWFLSA-N 288.435 3.495 70 20 CGID CCC[C@@H](NCC(=O)NCC(F)(F)F)C1CCCCC1 160581913 BTPVGIKLYFWDQG-GFCCVEGCSA-N 294.361 3.004 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)cc1C 160669854 KKIOPLLFXFLBKA-CQSZACIVSA-N 276.380 3.383 70 20 CGID Cn1cnnc1CN1CCC[C@@H]1c1cccc2ccccc12 160843143 RTHCVQZEDRLDDP-QGZVFWFLSA-N 292.386 3.305 70 20 CGID CC(C)CC(=O)N[C@@H]1CCOC2(CCCCC2)C1 160964491 YKXDDXNMSBTDSD-CYBMUJFWSA-N 253.386 3.031 70 20 CGID CCCCCNC(=O)[C@H](C)Nc1ccn(CCC(C)C)n1 159869081 NONOTWCYDHHHOF-AWEZNQCLSA-N 294.443 3.036 70 20 CGID CC[C@H](NC(=O)Nc1ccc(F)cc1C)[C@@H]1CCCO1 159541721 JEZQQAIUVIMQPJ-JSGCOSHPSA-N 280.343 3.213 70 20 CGID Cc1cscc1NC(=O)c1cccc(-c2ncn[nH]2)c1 159555359 MFLDLRBFMDBEPI-UHFFFAOYSA-N 284.344 3.094 70 20 CGID Cc1cc(C(=O)N(C)CCOCc2ccccc2)c(C)o1 159385107 JGRKHPVMTXWPQG-UHFFFAOYSA-N 287.359 3.185 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N1C[C@@H](c2ccccc2)C[C@@H]1C 159789322 WUHDSNIWZKACBM-ILXVDBEPSA-N 299.414 3.396 70 20 CGID C1CCC(N2CCC(N[C@@H]3CCCSC3)CC2)CC1 159522130 XDNBRNNXRKKQEM-OAHLLOKOSA-N 282.497 3.269 70 20 CGID CCSCC[C@@H](C)NC[C@@H](O)c1ccc(F)c(F)c1 160127298 DLUGSWBGKZGCKZ-QMTHXVAHSA-N 289.391 3.120 70 20 CGID Cc1cc(CNCC23CC4CC(CC(C4)C2)C3)on1 216848507 XNDOVVFFQXQZEU-UHFFFAOYSA-N 260.381 3.289 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cc(C(C)=O)cn1C 161283047 OQXAJYRUEOFABA-HIFRSBDPSA-N 290.407 3.269 70 20 CGID COCCC1(C(=O)N(C)CCC2CCCCC2)CC1 161346074 BDCROLLOZAFYES-UHFFFAOYSA-N 267.413 3.232 70 20 CGID CC(C)(C)CCNC(=O)COc1ccc2[nH]ccc2c1 160080274 JFSQXFGTSQOAJG-UHFFFAOYSA-N 274.364 3.099 70 20 CGID C[C@@H](CC(=O)NC(C)(C)c1nccs1)c1ccncc1 160636701 XCLGEMGDQDAQQG-NSHDSACASA-N 289.404 3.083 70 20 CGID CCCCCC[C@](C)(CC)C(=O)N1CCCNCC1 160851714 WPAYWKNDUSUICW-INIZCTEOSA-N 268.445 3.195 70 20 CGID CCc1nc2c(s1)[C@H](N(C)C(=O)NCC1CC1)CCC2 160886287 DCIUDWXZDBYHLP-GFCCVEGCSA-N 293.436 3.134 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H](C)C2CCOCC2)C1 159457339 VJUIPOWYZPMHNC-QEJZJMRPSA-N 271.470 3.455 70 20 CGID C[C@@H](CNC(=O)NC1(C)CCC1)COCc1ccccc1 159913146 YTWMXVQQJBMCMU-AWEZNQCLSA-N 290.407 3.081 70 20 CGID Cc1nn(-c2ccccc2)c(C)c1CN[C@H]1CCSC1 218619226 BGEJMSXIIFZCID-AWEZNQCLSA-N 287.432 3.084 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1cc(F)ccc1F 161056201 HIUDEEXJODHDIA-IBGZPJMESA-N 285.315 3.131 70 20 CGID O=C(NCc1ncccc1F)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 161322990 HQLVJPGICIETHR-MGPQQGTHSA-N 290.382 3.443 70 20 CGID CCCC1(CNC(=O)c2c(F)cccc2F)CC1 160813361 YGDMJTGKAJYPSA-UHFFFAOYSA-N 253.292 3.275 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(F)c(NC(C)=O)c1 160840408 UIYDUMRSQZCKBN-IAQYHMDHSA-N 278.327 3.159 70 20 CGID CC[C@H](CC(=O)N[C@H](CO)CC(C)C)c1ccc(C)cc1 160854283 LDTPNFGSVSJJIW-WBVHZDCISA-N 291.435 3.402 70 20 CGID Cc1cc([C@@H](C)NC(=O)c2ccc(O)nc2C)c(C)s1 159628937 OXGJMPLYBWEUJL-SNVBAGLBSA-N 290.388 3.265 70 20 CGID CCOCCC1(CNC(=O)[C@H](C)c2cccc(C)c2)CC1 159437524 FWYOXCBSTAXRKD-OAHLLOKOSA-N 289.419 3.422 70 20 CGID Cc1cccc(NC(=O)c2cc(F)c(C)cc2F)n1 159880708 HAISJVLJCZMYEU-UHFFFAOYSA-N 262.259 3.229 70 20 CGID COC(=O)CCCC(=O)N(CC(C)(C)C)CC(C)(C)C 159895297 QQNHSQSPRVISSZ-UHFFFAOYSA-N 285.428 3.251 70 20 CGID COCCOc1ccc([C@H](C)N[C@@H]2CCCSC2)cc1 159555088 XZZDYNYAHSJPIO-DZGCQCFKSA-N 295.448 3.258 70 20 CGID CC(C)CCCOCC(C)(C)CS(=O)(=O)Cl 114472805 YTRBMVWLRMWVAJ-UHFFFAOYSA-N 270.822 3.034 70 20 CGID C[C@@H]1Cc2ccccc2[C@@H]1N[C@@H]1CCC[C@H](N(C)C)C1 161051113 QCQVZHXRIFGHAM-NYCLONFESA-N 272.436 3.382 70 20 CGID Cc1cccc(C)c1NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 161064580 PDGOYQYFGGCAJW-HUUCEWRRSA-N 288.391 3.383 70 20 CGID O=C(CC(F)(F)F)N1CCc2c(Cl)cccc21 161433548 WQQFWDUCPCKJON-UHFFFAOYSA-N 263.646 3.182 70 20 CGID C[C@H]1CCCC[C@H]1NC(=O)COc1ccc2[nH]ccc2c1 160019341 IPORJJHCZCHQHU-SWLSCSKDSA-N 286.375 3.242 70 20 CGID C[C@@H](CC(=O)N(C)Cc1cccn1C)c1ccccc1F 160482589 ZLLRCBNBVVTFMQ-ZDUSSCGKSA-N 288.366 3.316 70 20 CGID CCCC1(CNC(=O)[C@@](C)(O)[C@H](C)c2ccccc2)CC1 160682079 DAJKOYUTLRKUSZ-PBHICJAKSA-N 289.419 3.238 70 20 CGID Fc1cccc(NC(=S)NC2CCCC2)c1F 159477251 LFEXLPWEKJNYTR-UHFFFAOYSA-N 256.321 3.194 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCCc3cc(N)ccc32)cc1 159372852 QEYCQEAZRDWIFN-KRWDZBQOSA-N 280.371 3.385 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)C1(c2ccccc2)CC1 159394319 ZWTMXALEMGVOGA-INIZCTEOSA-N 299.414 3.326 70 20 CGID COc1ccc2c(c1)C[C@H](NCC1CCSCC1)CC2 159559402 NJWAZKFBBNJQIK-MRXNPFEDSA-N 291.460 3.285 70 20 CGID CC[C@H](C)[C@@H](NCc1cc(Cl)ccc1F)C(=O)OC 160743958 WMLRIVADRFVZEB-TVQRCGJNSA-N 287.762 3.156 70 20 CGID Fc1cc(Cl)cc(CNC[C@@H]2CCN(C3CC3)C2)c1 160892040 FFVZMEULRWDXRV-NSHDSACASA-N 282.790 3.053 70 20 CGID O=C(Cc1ccc(F)cc1Cl)NCC1(C2CC2)CC1 160018380 HJOBEAUEQHYESI-UHFFFAOYSA-N 281.758 3.328 70 20 CGID Cc1noc(C)c1CCSCc1nc(C2CC2)no1 160126723 SFRCVHGFXQHEBI-UHFFFAOYSA-N 279.365 3.028 70 20 CGID CC(C)c1cc(C(=O)N(CC(F)(F)F)C2CCC2)no1 160197677 HEGDUZQAPSBNQZ-UHFFFAOYSA-N 290.285 3.355 70 20 CGID CC[C@H](NC(=O)c1cc(Cl)c[nH]1)c1c(C)noc1C 160327182 AHFVVVCRQMFPHJ-JTQLQIEISA-N 281.743 3.154 70 20 CGID Cc1ccsc1CCCC(=O)NCCc1cccnc1 160647293 XREXAJNMRNMKTB-UHFFFAOYSA-N 288.416 3.133 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@@H]1c1cccc(F)c1F 159862707 YURAXBQQPYYTMP-CHWSQXEVSA-N 291.341 3.375 70 20 CGID CCOC(C)(C)CNc1ncccc1C(F)(F)F 159538606 YQXWEOWPJLXUAG-UHFFFAOYSA-N 262.275 3.327 70 20 CGID CCCC[C@H](Nc1nccc(C)n1)C(=O)OC(C)(C)C 159974464 GBQWFHJCBQMFGD-LBPRGKRZSA-N 279.384 3.097 70 20 CGID CCCn1c(C)nnc1CN1CCCC(C)(C)CC1 159583187 GSBRJTZYKKDZPT-UHFFFAOYSA-N 264.417 3.009 70 20 CGID O=C(N1CCCCCC1)N1CCC(C(F)(F)F)CC1 160640040 PYRAVHQJTXRFHI-UHFFFAOYSA-N 278.318 3.257 70 20 CGID Cc1cccc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)c1F 161458983 KYCXJFYZROGFPU-CQSZACIVSA-N 272.323 3.440 70 20 CGID COc1ccccc1CNC(=O)Nc1cc(Cl)ccn1 217313951 BTQPDEOSWHRIID-UHFFFAOYSA-N 291.738 3.065 70 20 CGID CCSCCN(C)Cc1ccc(OC)c(C)c1 160502839 QSFVNCMJMHPPLJ-UHFFFAOYSA-N 253.411 3.189 70 20 CGID Cc1ccc(SCCCS(=O)(=O)Cl)cc1 100495411 CHNGTLGFINELCO-UHFFFAOYSA-N 264.799 3.046 70 20 CGID CCOc1cc(NC(=O)C[C@@H](C)SC)ccc1OC 160135353 AVIMLSGHZSHOCG-SNVBAGLBSA-N 283.393 3.174 70 20 CGID CC[C@@H](CCO)NCc1ccc(F)c(C(F)(F)F)c1 160152897 LJCPGXJNURGXFL-JTQLQIEISA-N 279.277 3.095 70 20 CGID Cc1ccc(CNc2cc(C(=O)NC3CC3)ccc2C)o1 160243416 GTINUXBHCXYDLS-UHFFFAOYSA-N 284.359 3.401 70 20 CGID Cc1nc(CC(=O)N[C@@H]2CCc3ccccc32)c(C)s1 160313830 GSXRLGYSOWEHAH-CQSZACIVSA-N 286.400 3.106 70 20 CGID CC[C@@H](NC(=O)C(C)(C)CC)c1c(C)noc1C 160505710 JCYZMKSBPNKBGM-LLVKDONJSA-N 252.358 3.295 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(N(C)C)c(Cl)c1 160512759 CNDZREDWSZZQPR-SECBINFHSA-N 286.828 3.486 70 20 CGID C[C@@H](NCc1ccc(CN2CCOCC2)cc1)C(C)(C)C 160621527 UBYRFPPLHXPYBO-OAHLLOKOSA-N 290.451 3.043 70 20 CGID Cc1cccc(NC(=O)N[C@H]2CCOC(C)(C)C2)c1C 160660929 PCYRMEGXNOAHJB-ZDUSSCGKSA-N 276.380 3.383 70 20 CGID CCC(=O)c1cccc(NC(=O)c2cc(F)ccc2O)c1 160768610 UWILDFRBCKMXIW-UHFFFAOYSA-N 287.290 3.376 70 20 CGID CC(C)NCCC(=O)NCCCc1ccc(C(C)C)cc1 159607683 VZNJFWOSDVLZJL-UHFFFAOYSA-N 290.451 3.247 70 20 CGID CCO[C@@H](C)C(=O)N[C@H](c1cccc(C)c1)c1ccccn1 159815993 MWERCXUOTZSNHT-WMLDXEAASA-N 298.386 3.021 70 20 CGID C[C@H]1CN(C[C@@H]2CCCN2CCC2CCCC2)C[C@H](C)O1 159637608 FKKDDIHVPQFLIU-BQFCYCMXSA-N 294.483 3.140 70 20 CGID c1cnc2ccc(CN[C@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2c1 159478157 YAPOJXIEQDOQEW-SZMVWBNQSA-N 294.398 3.282 70 20 CGID C[C@H](Sc1ccncc1)C(=O)Nc1ccccc1 159889964 IREHRPSOKYIWRB-NSHDSACASA-N 258.346 3.201 70 20 CGID CC[C@H](NCCCN1CCCC1=O)c1ccc(F)cc1F 159531712 OTUBCPOFEGBUEI-HNNXBMFYSA-N 296.361 3.018 70 20 CGID COc1ccc(N(C)C(=O)c2sccc2C)cc1F 159540099 PHJSTDAHPOHMDL-UHFFFAOYSA-N 279.336 3.481 70 20 CGID CCC(CC)C(=O)N(C)c1ccc(OC)c(F)c1 159540231 WMFPADWDBGGTPA-UHFFFAOYSA-N 253.317 3.233 70 20 CGID COc1ccccc1[C@H](C)CC(=O)OCc1cncs1 159568301 ULANRFAONCLBQU-LLVKDONJSA-N 291.372 3.389 70 20 CGID CC(C)(C)CCC(=O)Nc1cccc(S(=O)(=O)F)c1 809280941 BNHPNBOVVOBEHC-UHFFFAOYSA-N 287.356 3.110 70 20 CGID CC[C@H](C)OCC(=O)Nc1ccc(COC(C)C)cc1 161042369 ZYNGURUYKGISPU-ZDUSSCGKSA-N 279.380 3.365 70 20 CGID CC(C)n1nccc1C(=O)N1CCC2(CCCCC2)C1 161086278 UAWSALJTMKNXCZ-UHFFFAOYSA-N 275.396 3.260 70 20 CGID Cc1cc(C(=O)N(C)[C@H](C)c2cc3ccccc3o2)ncn1 161450764 OQWZBFQEMDUJDN-GFCCVEGCSA-N 295.342 3.364 70 20 CGID Cc1ncsc1CNc1ccc(C(F)(F)F)nc1 160071493 UXUVABDRUODDLL-UHFFFAOYSA-N 273.283 3.477 70 20 CGID C[C@@H](C(=O)N(C)C1CC1)c1ccc(Br)cc1 160085604 PXCSBSQORIZADU-SECBINFHSA-N 282.181 3.173 70 20 CGID CC(C)[C@@H]1CCC[C@H](NC(=O)N(C)C[C@@H]2CCC[C@@H]2O)C1 160774925 GSGNJXFQOLQTHS-UGUYLWEFSA-N 296.455 3.004 70 20 CGID CCC(CC)(CC)NC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 160894451 GVJAUDVCUYGLII-MCIONIFRSA-N 294.439 3.212 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H](COC)C(C)C)C1 159433610 YAOSTAGEFVCFLH-IHRRRGAJSA-N 259.459 3.311 70 20 CGID CCCCCOc1ccc(NC(=O)c2cnn(C)c2)cc1 159672398 MXRYXESCALCXAL-UHFFFAOYSA-N 287.363 3.241 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)COCC2CC2)C1 159548708 VYJFPOUYTMTSMU-GFCCVEGCSA-N 291.416 3.188 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1cc(F)ccc1F 159393735 DTCCYOBXYKTUJQ-LBPRGKRZSA-N 295.329 3.186 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)C1(c2ccccc2)CC1 159394182 ZWTMXALEMGVOGA-MRXNPFEDSA-N 299.414 3.326 70 20 CGID CO[C@@H]1CCCC[C@@H]1N[C@@H](C)CCc1ccc(O)cc1 218276851 DTHIHADINJYXRV-RRQGHBQHSA-N 277.408 3.261 70 20 CGID CN(C(=O)N1CCCCCC1)c1ccc(F)cc1 160482002 QTEWMVQBEMKJIF-UHFFFAOYSA-N 250.317 3.258 70 20 CGID Cc1ccc2cccc(NC(=O)c3ccc(O)nc3C)c2n1 161252163 HZTVUMBODGUWCC-UHFFFAOYSA-N 293.326 3.205 70 20 CGID Cc1cccc([C@H](NC(=O)CC2CC2)c2ccccn2)c1 160129958 AXPQDCYUPQNKAH-SFHVURJKSA-N 280.371 3.396 70 20 CGID COCC(C)(C)C(=O)Nc1nc2c(C)cccc2s1 160439599 VVKYBAISYSDYKI-UHFFFAOYSA-N 278.377 3.216 70 20 CGID CCN(CC)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 160550032 IGDUVBCHWYEPFU-GFCCVEGCSA-N 296.798 3.255 70 20 CGID CNCC(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1 160557621 VDDVHBCSDDBUIK-ZDUSSCGKSA-N 282.815 3.153 70 20 CGID CCCC1(CN[C@H](C(=O)OC)c2ccc(F)cc2)CC1 160774791 DIDPREYSIZXVJX-AWEZNQCLSA-N 279.355 3.210 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(N(C)C)nc1 160900268 SWKMWRMIJHXGER-HIFRSBDPSA-N 289.423 3.188 70 20 CGID CCOCCC1(CNC(=O)C[C@H]2CC[C@@H](C)C2)CC1 159477463 PTKDCQGAJGMWTA-KGLIPLIRSA-N 267.413 3.136 70 20 CGID Cc1n[nH]c(C)c1[C@@H](C)CC(=O)N(CC(F)F)C(C)C 159688493 LGMNNPUPAFOZOJ-VIFPVBQESA-N 287.354 3.022 70 20 CGID CS[C@@H]1CCC[C@H](NC(=O)[C@@H]2CCCCCC[C@@H]2N)C1 159573403 WGSAMKJZZSQODN-YJNKXOJESA-N 298.496 3.075 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)NC1CCCC1 159990598 GOEZAHWMNYKQIP-NSHDSACASA-N 296.436 3.226 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2cccnc2)n1 159791587 KCTAHZVAXFHAQA-MRXNPFEDSA-N 253.349 3.122 70 20 CGID CC[C@@H](CC(=O)Nc1ccc(OC)c(N)c1)C(C)C 161016171 RODNVPLQZZBMOZ-NSHDSACASA-N 264.369 3.288 70 20 CGID CC[C@H](NC(=O)[C@@H]1CC1(C)C)c1ccc2c(c1)OCCO2 160036782 OHBJRGPCNCPEIP-STQMWFEESA-N 289.375 3.071 70 20 CGID Cc1n[nH]c(C)c1CN(C)Cc1ccccc1Cl 160825393 GVQRFUXXIJJGCW-UHFFFAOYSA-N 263.772 3.312 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)CCCc1ccccn1 159802614 VQLTTWWIQYRDPM-UKRRQHHQSA-N 260.381 3.099 70 20 CGID C[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CC[C@H]1O 159366093 PDTYYWOBPKUNDF-MLGOLLRUSA-N 284.359 3.074 70 20 CGID O=C(Nc1ccc2ccccc2c1)N[C@H]1CC[C@H](O)CC1 159797654 IPZBUYIQEFZXAP-FZNQNYSPSA-N 284.359 3.265 70 20 CGID C[C@H](CCc1ccccc1)N[C@@H]1CCN2CCCC[C@@H]12 217678395 HXKKLKHUIQDGGZ-NXHRZFHOSA-N 272.436 3.224 70 20 CGID Cc1cccc(C)c1OCCCNC(=O)NCC(C)C 217298089 JAUMROFTWVQHCX-UHFFFAOYSA-N 278.396 3.028 70 20 CGID COCCC1(CNC(=O)N(C)[C@@H]2CCC[C@@H](C)C2)CC1 161028249 KRGCZIDPPUAWMJ-ZIAGYGMSSA-N 282.428 3.023 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)NCC1(CCOC)CC1 161109561 XUEFPDQVWSJFAG-HUUCEWRRSA-N 296.455 3.413 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)[C@@H](CC)CC1CCCC1 160083703 REHRWWFQTGLNOC-OCCSQVGLSA-N 283.412 3.051 70 20 CGID COc1ccc(N(C)C(=O)c2c(C)noc2C)cc1Cl 160231907 WYQYDVYUZOJTER-UHFFFAOYSA-N 294.738 3.230 70 20 CGID CC(C)(C)c1nsc(N[C@H]2CCO[C@H](C3CC3)C2)n1 160356254 INMAMQOQZYLADK-QWRGUYRKSA-N 281.425 3.205 70 20 CGID CC[C@H](C)CS(=O)(=O)N1CCC2(CCCC2)CC1 160601270 BTMIPAMCKSLJRZ-ZDUSSCGKSA-N 273.442 3.019 70 20 CGID CC(C)[C@@H]1CCCCN1C(=O)Nc1cccc(F)n1 160809854 QLEALGITYCSUOZ-NSHDSACASA-N 265.332 3.263 70 20 CGID COc1ccc(NC(=O)c2cccn2C(C)C)c(OC)c1 160936194 AZLMUJJFKCKUQY-UHFFFAOYSA-N 288.347 3.339 70 20 CGID CCCCN1CCC(NC(=O)[C@@H](C)c2cccs2)CC1 159628669 OANLQGVWADASNZ-ZDUSSCGKSA-N 294.464 3.232 70 20 CGID CC(C)C[C@@H](NCCO)c1cccc(C(F)(F)F)c1 159684317 NIFOUBYWFJGKJA-CYBMUJFWSA-N 275.314 3.375 70 20 CGID CCCCCNC(=O)[C@@H](C)N[C@H](C)c1cccc(F)c1F 159533250 NSQWOKIPXBAADP-VXGBXAGGSA-N 298.377 3.310 70 20 CGID CCN(C(=O)Nc1ccn(CCC(C)C)n1)C(C)C 159760947 LSSBMXPBOLTQRZ-UHFFFAOYSA-N 266.389 3.191 70 20 CGID C[C@@H]1CN(C)[C@H](C)C[C@H]1NCCCc1cccc(F)c1 159767801 PBYQQYMIKQOYOK-CKEIUWERSA-N 278.415 3.077 70 20 CGID CCS[C@H]1CCC[C@@H]1NC(=O)CCCn1cccc1 159797610 GNQLVWAZVWGZJF-KBPBESRZSA-N 280.437 3.059 70 20 CGID CC[C@@H](C)N(C)CCNCc1c(C)cc(C)cc1C 217377436 KQXWMMFQBAINOT-MRXNPFEDSA-N 262.441 3.432 70 20 CGID CC[C@H](CCO)NC(=O)C1(c2cccc(Cl)c2)CCC1 160088528 GWIBOLHACKVZBK-CQSZACIVSA-N 295.810 3.039 70 20 CGID CC[C@@H](C)NCc1ccccc1OCCN(CC)CC 160296382 LZZHEPKWILGZAA-OAHLLOKOSA-N 278.440 3.295 70 20 CGID Cc1ccc(CCNC(=O)NCCc2ccccc2)cc1 217304844 PKAIGBXXADDFOZ-UHFFFAOYSA-N 282.387 3.079 70 20 CGID CN(C[C@@H]1CCOC1)C(=O)CC1CCC(C)(C)CC1 161402654 YFIYCKZNBXEARN-AWEZNQCLSA-N 267.413 3.088 70 20 CGID CCCCn1ncc(C(=O)Nc2cccc(C)c2O)c1C 160023192 LBWJFGSMGNBWAC-UHFFFAOYSA-N 287.363 3.258 70 20 CGID CC1(C)CCC(CC(=O)NC[C@H]2CCN(C3CC3)C2)CC1 160140473 UCFBIFDYXKADPC-OAHLLOKOSA-N 292.467 3.193 70 20 CGID CC[C@H](CN[C@@H](C)c1cnn(C)c1)Oc1ccccc1F 160317016 GABHVGVUSGSCKU-GXTWGEPZSA-N 291.370 3.067 70 20 CGID CC[C@@H](C)OCC(=O)NCc1ccccc1OCC(C)C 160393343 JFNIWOZEZWUWLI-CQSZACIVSA-N 293.407 3.153 70 20 CGID CSC[C@H](CCO)N[C@@H](Cc1ccc(C)cc1)C1CC1 160436964 OZZNLYZFYZSTSM-IRXDYDNUSA-N 293.476 3.020 70 20 CGID CCC(N)(CC)CNC(=O)[C@H](C)c1cc2ccccc2o1 160482841 HAQUJKNZGZOARB-GFCCVEGCSA-N 288.391 3.170 70 20 CGID Cc1cnc(N[C@@H]2CCO[C@H](c3ccccc3)C2)nc1 160574079 SSHTVSNLRTVQIH-CABCVRRESA-N 269.348 3.117 70 20 CGID CN(C)C(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1 159818191 UZHNZGSHHVCVAW-UHFFFAOYSA-N 287.363 3.027 70 20 CGID CCC[C@@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1cccc(F)c1F 159459526 QSDHZXYZVBZHGI-GRYCIOLGSA-N 298.377 3.309 70 20 CGID CC[C@H](NC(=O)Nc1c(C)cccc1C)[C@@H]1CCCO1 159484957 MAFGFIXTZUPROC-KBPBESRZSA-N 276.380 3.383 70 20 CGID O=C(Cc1cccc(OC(F)(F)F)c1)Nc1ccncc1 159922408 KZJUOZWMFOIGSS-UHFFFAOYSA-N 296.248 3.161 70 20 CGID CCCC(=O)Nc1cccc(NC(=O)CO[C@H](C)CC)c1 159390733 GAUFKVYETKVEQI-GFCCVEGCSA-N 292.379 3.179 70 20 CGID CC[C@@H](C)N(C)CCNCc1ccc2ncccc2c1 217376727 WMCWAHAGPSKFRC-CQSZACIVSA-N 271.408 3.055 70 20 CGID O=c1[nH]c2ccc(NCc3cc(Cl)ccc3F)cc2[nH]1 160656845 OCXUGBAEVUFIIF-UHFFFAOYSA-N 291.713 3.261 70 20 CGID C(=C/c1ccccc1)\CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159481071 MLQNMOQZDIYCDP-QIUZGKPSSA-N 269.388 3.247 70 20 CGID CC(C)CN(CC(C)C)C(=O)NCCOc1ccccc1 217303662 KVMNDJQMFQMBAE-UHFFFAOYSA-N 292.423 3.389 70 20 CGID CCOC(C)(C)CNc1ccncc1Br 159534934 GJTBFKRFTBZCFS-UHFFFAOYSA-N 273.174 3.071 70 20 CGID Cc1cnc(C)c(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 160234223 QSRHQNNJDWTUEK-GUYCJALGSA-N 296.418 3.026 70 20 CGID COc1ccc(N(C)C(=O)c2cccc(C)n2)cc1Cl 160268142 FVESHVFRHROHMW-UHFFFAOYSA-N 290.750 3.329 70 20 CGID CCOc1ccc(Cl)cc1[C@@H](C)NC1CCN(C)CC1 161455415 ZJCBGBWPQOGQBU-GFCCVEGCSA-N 296.842 3.484 70 20 CGID Cc1cc(C)cc(CCNC(=O)NC2(C)CCC2)c1 161468995 GXVZJOHNIQEGRH-UHFFFAOYSA-N 260.381 3.088 70 20 CGID COC[C@@H]1CCCN(C(=O)C2CCC(C)(C)CC2)C1 160356232 BUAKFAADLMIXFJ-CYBMUJFWSA-N 267.413 3.088 70 20 CGID CCc1ccc([C@@H](C)N[C@H](CCO)CSC)s1 160409434 LQIXCQWRSPEUQE-GHMZBOCLSA-N 273.467 3.075 70 20 CGID CC(C)c1cc(=O)n(C/C=C/c2ccccc2)cn1 160802929 OVRPLVSJFVHUKZ-RMKNXTFCSA-N 254.333 3.080 70 20 CGID CCc1ccc(/C=C/C(=O)N(CC(F)F)C2CC2)o1 159857489 UUUUWCKMGNOJJQ-BQYQJAHWSA-N 269.291 3.111 70 20 CGID Cc1cccc(C)c1NC(=O)N(C)[C@@H]1CCSC1 159483968 INMBHOCXYANKPE-GFCCVEGCSA-N 264.394 3.273 70 20 CGID c1ccc(C[C@H](N[C@H]2CCCSC2)C2CC2)cc1 159529492 VHGHKTWWTCYACN-HOTGVXAUSA-N 261.434 3.493 70 20 CGID COCCOc1cc(C)ccc1NC(=O)[C@@H]1CC1(C)C 159565914 ZAMUOEGLKRGQLF-LBPRGKRZSA-N 277.364 3.005 70 20 CGID C[C@H]1CC[C@@H](C(=O)Nc2cc(C(C)(C)C)ccc2O)O1 159571857 JEUNTWXOUYELGN-HZMBPMFUSA-N 277.364 3.196 70 20 CGID Cc1cc(NC(=O)N(C)CCC2CC2)cnc1Cl 159991521 FCGUSIQITDCNHU-UHFFFAOYSA-N 267.760 3.307 70 20 CGID CCn1cc([C@@H](C)Nc2ccc(F)c(OC)c2)cn1 160044747 DLMRXWABRJJXKD-SNVBAGLBSA-N 263.316 3.224 70 20 CGID CCOC(C)(C)CNc1ccc(Br)cn1 159506432 GXHUIMUKGMAFTP-UHFFFAOYSA-N 273.174 3.071 70 20 CGID CCC[C@@H](C(=O)N(CC(=O)OC)C1CCCC1)C(C)C 161029806 HCJIMCVWVFSFCB-CQSZACIVSA-N 283.412 3.003 70 20 CGID CCCCN(CCOC)c1nc(C(C)(C)C)ns1 159410928 XNBPKUPXTIWAQK-UHFFFAOYSA-N 271.430 3.089 70 20 CGID CO[C@H](C)C(=O)N1CCCC[C@H]1CCCc1ccccc1 161169625 QIWMFIFNFQNLMK-WBVHZDCISA-N 289.419 3.425 70 20 CGID Cc1ccc(CNC(=O)[C@@H](C)Sc2ccncc2)cc1 160033647 QEINRHUGVUYDJL-CYBMUJFWSA-N 286.400 3.187 70 20 CGID CCc1ccc([C@H](C)NC[C@](C)(O)c2ccsc2)o1 160136790 KDJNLKJCEMDYQD-NHYWBVRUSA-N 279.405 3.462 70 20 CGID C[C@@](O)(CNc1cncc(Cl)n1)c1ccccc1Cl 160196101 FXWUNAZJYNGRKJ-CYBMUJFWSA-N 298.173 3.103 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCC(C)CC2)n1 160672292 YFNGPYWSXYJCNR-UHFFFAOYSA-N 278.400 3.193 70 20 CGID C[C@H]1CCC[C@@H](NC(=O)N(CCN(C)C)C2CCCC2)C1 160916906 FIOHJXPGPGGIQJ-LSDHHAIUSA-N 295.471 3.081 70 20 CGID CCOC[C@@H]1CCN(C(=O)c2cc(C)cc(Cl)c2)C1 159450899 WILHJHGDBRPUTH-GFCCVEGCSA-N 281.783 3.147 70 20 CGID CCOc1ncccc1NC(=O)C[C@H](C)c1ccncc1 159860523 UMAOQZLXQAQZAT-LBPRGKRZSA-N 285.347 3.008 70 20 CGID COc1ccccc1-c1ccc([C@@H](C)NCCO)cc1 159687452 UYCSPBKSJZDODX-CYBMUJFWSA-N 271.360 3.005 70 20 CGID COCC(C)(C)C(=O)N[C@@H](C)c1cc2ccccc2o1 159775167 PBJFKNRVHQAXAH-NSHDSACASA-N 275.348 3.283 70 20 CGID CC1(C)C[C@@H](NC[C@H]2CCOc3ccccc32)CCO1 159776771 BCXIPPBHZDONRE-KGLIPLIRSA-N 275.392 3.100 70 20 CGID Cc1occc1C(=O)N[C@@H](C)CC(=O)c1ccc(F)cc1 161216899 KROXXQJJNHOBJC-JTQLQIEISA-N 289.306 3.118 70 20 CGID COc1ccc(N(C)C(=O)C(C)(C)C2CCCC2)cn1 161219293 UCHNSSWETYPTIS-UHFFFAOYSA-N 276.380 3.269 70 20 CGID CC[C@H](N)C(=O)N(C)[C@@H](c1ccccc1Cl)C(C)C 160078839 JDDJQUSKQSJOMC-UONOGXRCSA-N 282.815 3.233 70 20 CGID CCCN(CCC)C(=O)COc1ccc(SC)cc1 160477973 HNTPSONZGZBSGT-UHFFFAOYSA-N 281.421 3.436 70 20 CGID CC(C)c1cc(=O)n(Cc2ccccc2Cl)cn1 160687215 USZWRWREOGCKPE-UHFFFAOYSA-N 262.740 3.068 70 20 CGID Cc1ccccc1NC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 160657654 KVOMNYLNNFXBBN-YUELXQCFSA-N 286.375 3.074 70 20 CGID Cc1ccc(C(C)(C)CC(=O)N[C@@H](CO)CC(C)C)cc1 160881621 QJAYGIWUNGLEFV-MRXNPFEDSA-N 291.435 3.186 70 20 CGID CCc1ccc([C@H](CO)Nc2ccnc(C3CC3)n2)cc1 160900900 DDAZIOBAWIQRHS-HNNXBMFYSA-N 283.375 3.062 70 20 CGID CC(=O)NC1CCC(N[C@@H](C)c2ccccc2C)CC1 159411142 ALURNYAILJYZSQ-JEYLPNPQSA-N 274.408 3.093 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)cc1 159920103 BHHHEZHMTCTKAJ-HNNXBMFYSA-N 273.376 3.217 70 20 CGID CC1(O)CCN(C(=O)c2cc3c(F)cccc3s2)CC1 161295818 FKAOYMBNJBGLRB-UHFFFAOYSA-N 293.363 3.027 70 20 CGID COc1ccc(-c2ccnn2C)c(C(F)(F)F)c1 218623519 WNPDQFVGVHMFOF-UHFFFAOYSA-N 256.227 3.115 70 20 CGID COC(=O)C1(NCCc2ccccc2Cl)CCCCC1 217095887 QJFLEGJHGUXUCS-UHFFFAOYSA-N 295.810 3.348 70 20 CGID Cc1cc(C)n(CCCNCc2cccc3cc[nH]c23)n1 218072147 RCYQEZHSSHKGCK-UHFFFAOYSA-N 282.391 3.161 70 20 CGID CC(C)=CCOC(=O)c1ccc(OCC(F)(F)F)nc1 218022132 RTYZHTMOPCBRBH-UHFFFAOYSA-N 289.253 3.146 70 20 CGID C[C@H](CSC(C)(C)C)NCc1cn2ccccc2n1 159420711 IYELVIIOJIIYQL-GFCCVEGCSA-N 277.437 3.344 70 20 CGID CC(C)[C@H](O)C(C)(C)CNc1nc(C(C)(C)C)ns1 160098884 XMOQJELTADUKGB-JTQLQIEISA-N 285.457 3.291 70 20 CGID CC(C)OCCOc1cc(Br)ccc1F 160645372 SYVXVRHGJBCNGE-UHFFFAOYSA-N 277.133 3.392 70 20 CGID O=C([C@H]1CCCCO1)N(Cc1ccc(F)cc1F)C1CC1 161017950 OLODZTQUSZQKQJ-OAHLLOKOSA-N 295.329 3.025 70 20 CGID CC(C)Oc1ccc(NC(=O)N(C)[C@H]2CCSC2)cc1 161137133 DIMALUIZZNVNFW-ZDUSSCGKSA-N 294.420 3.443 70 20 CGID CCC(CC)(CN)C(=O)N[C@H]1CCC[C@H]1c1ccccc1 161223216 SMQPDHJQFQVRCY-HOTGVXAUSA-N 288.435 3.204 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C)nc1 161231682 CYSNLSVTLVSGKQ-ZFWWWQNUSA-N 260.381 3.431 70 20 CGID C[C@H](N[C@H]1CCOc2c(Cl)cccc21)c1cnccn1 161279597 YCLLNLXLOUJZHN-GWCFXTLKSA-N 289.766 3.304 70 20 CGID CCCn1nc(C)c([C@H]2NC(=O)c3c(C)cccc3N2)c1C 160148450 JNIVBLZBNVAPLJ-MRXNPFEDSA-N 298.390 3.072 70 20 CGID COc1ccc(N(C)C(=O)[C@@H]2CCCS2)cc1Cl 160149662 WNSUQNIWNNPVHQ-LBPRGKRZSA-N 285.796 3.207 70 20 CGID COCCC[C@@H](C)C(=O)N[C@@H]1CCCc2sccc21 160240170 JKNFAKGQNJSKPH-DGCLKSJQSA-N 281.421 3.304 70 20 CGID CCCC1(CNC(=O)NCC2(C3CC3)CC2)CC1 160336607 BKNSXKIQLRORSA-UHFFFAOYSA-N 250.386 3.056 70 20 CGID CCCCSCCC(=O)Nc1cccc(F)n1 160621980 KBSQNORKZMXSEK-UHFFFAOYSA-N 256.346 3.083 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)c1ccccc1 160700656 PNZUIEGRHFXSBG-LLVKDONJSA-N 273.357 3.139 70 20 CGID COc1ccc([C@H]2CCN(Cc3nccn3C(C)C)C2)cc1 160896596 NDWPMAZYECRMGJ-INIZCTEOSA-N 299.418 3.462 70 20 CGID COc1cc(F)ccc1NC(=O)C[C@H](C)c1ccncc1 159673239 QJDCLRZGBXAVOA-NSHDSACASA-N 288.322 3.362 70 20 CGID CCCN(Cc1ccncc1)[C@H](C)C(=O)Nc1ccccc1 159962970 SJJQAJIYHLSRRF-OAHLLOKOSA-N 297.402 3.321 70 20 CGID CCN(CCNc1nc(Cl)nc2ccccc12)C1CC1 218674041 ZIXGMUGZZZCCEH-UHFFFAOYSA-N 290.798 3.179 70 20 CGID C[C@H](N[C@@H]1CCC[C@@H](O)C1)c1ccc2c(c1)CCC2 217625055 ASLPWZWRGBLTLZ-JCURWCKSSA-N 259.393 3.129 70 20 CGID O=C(CCN1CC[C@@H]2CCCC[C@@H]21)Nc1ccccc1 159588531 MBKOHOKBHCPZQZ-HOCLYGCPSA-N 272.392 3.280 70 20 CGID CCCn1nccc1CNc1ccc(OCC)c(F)c1 160200291 CFQJOMQARINTSM-UHFFFAOYSA-N 277.343 3.443 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cc(F)cc(F)c1 161080181 JITPDQUFQWLWEL-RLCCDNCMSA-N 282.378 3.488 70 20 CGID COC[C@H](NC(=O)[C@H](C)Cc1ccc(Cl)cc1)C1CC1 161283947 XWEJRCWVSGOWKM-ABAIWWIYSA-N 295.810 3.060 70 20 CGID COc1cc(F)c(C(=O)N[C@@H]2CCCC[C@H]2C)cc1OC 161286817 BUPNIGWXLMYBKE-ZWNOBZJWSA-N 295.354 3.151 70 20 CGID Cc1ccc(C(=O)CCN[C@@H](CCO)c2ccccc2)cc1 161436036 DVYZLVURMKITRI-SFHVURJKSA-N 297.398 3.281 70 20 CGID O=C(CC[C@H]1CCOC1)N[C@H]1CCCc2sccc21 160092486 CFQPPKFXVONPCX-AAEUAGOBSA-N 279.405 3.058 70 20 CGID Cc1nccn1CCCCNC(=O)C1CCC(C)(C)CC1 160664042 INQDYBMCTDGKIG-UHFFFAOYSA-N 291.439 3.304 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)[C@@H]1CCOc2ccccc21 159839659 NATPNQWHLOQUQH-NWANDNLSSA-N 273.376 3.248 70 20 CGID CC(C)[C@H](O)CNC(=O)c1ccc(Oc2ccccc2)cc1 159695433 ZOOSFKBTRCZMAL-QGZVFWFLSA-N 299.370 3.226 70 20 CGID CC[C@H](CC(=O)Nc1cccn(C)c1=O)c1ccc(C)cc1 159918623 BPWAUMRSROHFAX-CQSZACIVSA-N 298.386 3.216 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@@H]2C[C@H]2C)C1 159528343 OHZHKVQVCWFOPC-QJPTWQEYSA-N 261.390 3.417 70 20 CGID COCC(C)(C)C(=O)N[C@H](C)c1cc2ccccc2o1 159775285 PBJFKNRVHQAXAH-LLVKDONJSA-N 275.348 3.283 70 20 CGID O=C(c1ccc(Br)cc1)N1[C@H]2C=CC[C@H]1CC2 218736601 YTWCYBZKYBHKGO-STQMWFEESA-N 292.176 3.382 70 20 CGID CS[C@@H](C)CNC(=O)c1ccc2ccccc2c1O 159437091 VTHKWWBMPRNRTO-JTQLQIEISA-N 275.373 3.027 70 20 CGID CCCn1nccc1CNCCc1ccc(Cl)cc1 159976064 MOEUDOBQCXVJPC-UHFFFAOYSA-N 277.799 3.279 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCc2cc(F)ccc21 160060110 RFHPJYWLPZOFDA-MLGOLLRUSA-N 264.388 3.133 70 20 CGID COC(=O)C1(NCc2ccccc2Cl)CCCCC1 217097223 AUGOMNNQILTFRJ-UHFFFAOYSA-N 281.783 3.306 70 20 CGID CC(C)Oc1ccccc1CN[C@H]1c2ccccc2C[C@@H]1O 216987753 NKJIDKUANYBCFU-HKUYNNGSSA-N 297.398 3.222 70 20 CGID COc1ccc(NC(=O)C[C@H]2CCC[C@H](C)C2)cc1N 161230577 WKDGMBOBHDQJSQ-RYUDHWBXSA-N 276.380 3.432 70 20 CGID Cc1cccc(C(=O)N(CC(F)(F)F)C2CC2)c1F 161478028 WTPRMWBODDUXFQ-UHFFFAOYSA-N 275.245 3.301 70 20 CGID CC[C@@H](C)NC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 160183248 KEUYOCIZPICODZ-MDZLAQPJSA-N 282.409 3.018 70 20 CGID CC[C@@H](N[C@H](CCO)CSC)c1ccc(F)cc1F 160288132 KQWMXDZEFGJFAN-BXUZGUMPSA-N 289.391 3.120 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)N[C@@H]1CCCc2sccc21 160385546 KFDDLFVEHHIAHK-MPKXVKKWSA-N 291.416 3.247 70 20 CGID O=C([C@@H]1CCCCO1)N(Cc1ccccc1)c1ccccn1 160493569 XBSGEEBFIUVUAG-INIZCTEOSA-N 296.370 3.184 70 20 CGID COCc1ccc(CN(C)Cc2ccccc2C)o1 160516734 YJGFBXAOYZVZSK-UHFFFAOYSA-N 259.349 3.366 70 20 CGID COC(CN1CCC[C@@H]1c1cccc(Cl)c1)OC 160619009 KZILWRQRDLSFGI-CYBMUJFWSA-N 269.772 3.096 70 20 CGID CC(C)[C@H](O)CCNC(=O)CC[C@H](C)c1ccccc1 160836390 LGEAHNDFORCLTM-GOEBONIOSA-N 277.408 3.094 70 20 CGID CC(C)CSCCCNC(=O)C[C@H]1C=CCC1 160874258 CWYAUAAUJGCYQQ-ZDUSSCGKSA-N 255.427 3.238 70 20 CGID CC[C@H](NC(=O)Nc1cc(F)ccc1C)[C@H]1CCCO1 159405479 SOLMXLUYXPZGDC-GXTWGEPZSA-N 280.343 3.213 70 20 CGID CC(C)c1ccc(C(=O)N(C)CCOc2ccccc2)cn1 159816822 XHGKJPPTOHJGKG-UHFFFAOYSA-N 298.386 3.356 70 20 CGID CCc1cccc(NC(=O)N[C@H](CC)[C@H]2CCCO2)c1 159459901 ZSIQCQATOCMRPL-HUUCEWRRSA-N 276.380 3.328 70 20 CGID c1cnc2c(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cccc2c1 159540911 PBTNIFNJNDYMIP-JQHSSLGASA-N 294.398 3.282 70 20 CGID CCc1noc(C)c1CNc1ccccc1COC 159393454 BVSKDPSWALONGM-UHFFFAOYSA-N 260.337 3.304 70 20 CGID O=C(c1cccc(F)c1F)N1CC=C(C(F)(F)F)CC1 160575925 AXLGSCLCHSLGBC-UHFFFAOYSA-N 291.219 3.299 70 20 CGID COc1cccc([C@@H](O)CN[C@@H](C)c2cccs2)c1 160717726 QXCGMAMTNKRDII-FZMZJTMJSA-N 277.389 3.141 70 20 CGID CC(C)S(=O)(=O)CCCN1CC[C@H](C)c2ccccc21 160848419 SQANZRYWLDBZNF-AWEZNQCLSA-N 295.448 3.214 70 20 CGID C[C@@H]1CCCC[C@H]1NC(=O)NCCCOc1ccccc1 217299733 VITMWBWYWCWVNH-GDBMZVCRSA-N 290.407 3.333 70 20 CGID C[C@@H](CN[C@@H](C)C1(C)CC1)N(C)Cc1ccccc1 160883739 BHLILOHZNXTQLV-GJZGRUSLSA-N 260.425 3.285 70 20 CGID CCC[C@H](C)CC(=O)Nc1ccc(S(=O)(=O)F)cc1 776368599 ZGJNUAFMHKRUMQ-JTQLQIEISA-N 287.356 3.110 70 20 CGID O=C(NC1CC=CC1)c1cc(Cl)ccc1OC(F)F 161044807 ZXZYPGKLTAYYJZ-UHFFFAOYSA-N 287.693 3.390 70 20 CGID COc1cc(F)c(C(=O)Nc2cccc(C)c2)cc1OC 161135966 PVZZXWGQNUZSBR-UHFFFAOYSA-N 289.306 3.404 70 20 CGID Cc1cccc(C(=O)Nc2ccccc2CN(C)C)c1F 161457946 UUPVCRCVFGSBRX-UHFFFAOYSA-N 286.350 3.448 70 20 CGID COCC(C)(C)C(=O)Nc1ccc(SC)cc1 160425758 ZOWDJBKTWFFWAT-UHFFFAOYSA-N 253.367 3.020 70 20 CGID CCOc1ccc(NC(=O)C[C@H](C)SC)c(C)c1 160518306 BKWPFKBDHCGIBM-NSHDSACASA-N 267.394 3.474 70 20 CGID c1ccc2c(c1)OCCC[C@@H]2N[C@@H]1CCCSC1 159608714 ZTPLCCXOAMJPNP-OCCSQVGLSA-N 263.406 3.386 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1cc(F)cc(F)c1 159683788 RZZPWFUXXVPWNV-AWEZNQCLSA-N 295.329 3.186 70 20 CGID O=C(CCC(=O)c1ccc(F)cc1)NCC1(C2CC2)CC1 159942551 BAJJERRGWOFCOR-UHFFFAOYSA-N 289.350 3.095 70 20 CGID Cc1cc(F)c(C(=O)NCCc2cccs2)cc1F 159786201 MJHIHZCSMQMILG-UHFFFAOYSA-N 281.327 3.307 70 20 CGID COC(=O)[C@H](C)CSC/C=C\c1ccccc1 217356138 FQZCHQKPUVMVIU-OJIASSBASA-N 250.363 3.242 70 20 CGID COC(=O)c1ccc(OCC2CCCCC2)c(OC)c1 216658634 UHNMQTIGQMEPEB-UHFFFAOYSA-N 278.348 3.441 70 20 CGID Cc1c(C(=O)NC[C@@H](C)CCO)oc2c(Cl)cccc12 161038335 PRMKVJGXTCHANW-VIFPVBQESA-N 295.766 3.143 70 20 CGID CCC(CC)n1nccc1C(=O)NCCCOCC(C)C 161190736 VSPAVQSEXNUDIO-UHFFFAOYSA-N 295.427 3.037 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1scnc1C 161228078 SCGPXPFOEUJUJQ-NWDGAFQWSA-N 266.410 3.492 70 20 CGID CCOc1cccc(NC(=O)NCC2(C3CC3)CC2)c1 161298270 XZYDENCAMWQAIY-UHFFFAOYSA-N 274.364 3.397 70 20 CGID CC(C)c1cc(=O)n(Cc2ccccc2C(F)(F)F)cn1 160693898 JVYBGJOSJIKMBH-UHFFFAOYSA-N 296.292 3.434 70 20 CGID CC(C)[C@@H](O)CCNC(=O)CC[C@H](C)c1ccccc1 160836513 LGEAHNDFORCLTM-HOCLYGCPSA-N 277.408 3.094 70 20 CGID Cc1cc(C)c(C(=O)Cn2cnc(C(C)C)cc2=O)cc1C 160893650 DFVPWYQZMHISKJ-UHFFFAOYSA-N 298.386 3.175 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@@H](C)c1ccc2ccccc2c1 160935344 CODPHMXGVYUMOC-KBXCAEBGSA-N 299.414 3.467 70 20 CGID Cc1cnc([C@H](C)NC(=O)NCC2(C3CC3)CCC2)s1 159398708 XIJUTVOKEOBEHQ-NSHDSACASA-N 293.436 3.392 70 20 CGID CCc1noc(C)c1CNc1ccc(OC)c(F)c1 159398793 YYORQLUEPUODED-UHFFFAOYSA-N 264.300 3.305 70 20 CGID CC[C@H](C)[C@H](O)CNC(=O)CCC(C)(C)c1ccccc1 159399536 PQWMXIFMFQZGQP-GOEBONIOSA-N 291.435 3.268 70 20 CGID Cc1ccc(OC(=O)[C@H]2CCCCO2)c(Br)c1 159993154 BWHFAIIKHHVXQS-GFCCVEGCSA-N 299.164 3.232 70 20 CGID CCSCC[C@H](C)NC[C@H](O)c1ccc(F)cc1F 160170636 HVWJAMWFELQGRO-HZMBPMFUSA-N 289.391 3.120 70 20 CGID CCOC(=O)[C@H](c1ccccc1)N(C)Cc1ccccc1 217671271 OHLDOFYGKKOKIC-KRWDZBQOSA-N 283.371 3.423 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1c1nc(-c2cnccn2)no1 161029781 UZYSVTOTZYZFEH-ZJUUUORDSA-N 284.344 3.168 70 20 CGID CC(C)(C(=O)N[C@H]1CCC[C@H](N)C1)c1ccccc1Cl 161284958 PGKFSHMIVCRKJR-RYUDHWBXSA-N 294.826 3.004 70 20 CGID CCCCNC(=O)c1ccc(CN[C@@H](CC)C2CC2)cc1 160117592 NLBDISMVZFUHGL-KRWDZBQOSA-N 288.435 3.495 70 20 CGID Cc1ccc2c(c1)[C@@H](NC(=O)N[C@H](C)CC(C)C)CO2 160531760 GNUHIRPPISAUNM-OCCSQVGLSA-N 276.380 3.162 70 20 CGID Cc1ccc(-c2n[nH]cc2CN[C@H]2CCOC(C)(C)C2)cc1 160554462 PGGWWKGKQBDGKJ-INIZCTEOSA-N 299.418 3.432 70 20 CGID CN(CCNCc1cccc2c1NCCC2)C1CCCC1 159415213 XJELEUWHQHUMEX-UHFFFAOYSA-N 287.451 3.009 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(C)s2)cc1F 159465082 QVCZMCKZVAMRHX-UHFFFAOYSA-N 279.336 3.481 70 20 CGID Cc1ccc(CN[C@@H](C)c2ccc(F)cc2N(C)C)cn1 161311187 JSPHGWYBHRTTRS-ZDUSSCGKSA-N 287.382 3.446 70 20 CGID CC[C@H](S[C@@H]1CCN(C)C1=O)c1ccc(F)cc1 161354302 WBFGJGNPSAWPAS-QWHCGFSZSA-N 267.369 3.241 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)c2cc[nH]c2C)o1 161410996 ONCNRYNFRNTAJQ-CQSZACIVSA-N 288.347 3.040 70 20 CGID CCC1(CC)[C@H](N[C@@H](C)c2ccncc2)C[C@H]1OC 160102334 CKXOETHGQDDVAP-NWANDNLSSA-N 262.397 3.326 70 20 CGID COCCN(C)C(=O)NCc1c(C)c(C)c(C)c(C)c1C 160590305 FGFDCYQXJCBOHU-UHFFFAOYSA-N 292.423 3.017 70 20 CGID CCC1(CNC(=O)Nc2cc(C(=O)OC)cs2)CCC1 160780855 JBDNSOSEZYVLHR-UHFFFAOYSA-N 296.392 3.237 70 20 CGID CC[C@@H](Nc1ccn(CCOC)n1)c1ccc(F)cc1F 160927235 AJUFVKMJHVNBTF-CQSZACIVSA-N 295.333 3.371 70 20 CGID CCc1nnc([C@@H](C)N[C@H](C)c2cccc(F)c2F)o1 159406620 AXRQIKOLQJMERN-RKDXNWHRSA-N 281.306 3.322 70 20 CGID COc1ccc(N(C)C(=O)c2c(F)cccc2F)cc1F 159395562 OGUQKHZLJYPKSM-UHFFFAOYSA-N 295.260 3.389 70 20 CGID c1ccc(C[C@@H](N[C@@H]2CCCSC2)C2CC2)cc1 159529384 VHGHKTWWTCYACN-HZPDHXFCSA-N 261.434 3.493 70 20 CGID CCc1ncnc(N[C@H](C)CCc2ccco2)c1F 217959209 VZTZTHJDNXEFCZ-SNVBAGLBSA-N 263.316 3.204 70 20 CGID NC(=O)c1cccc(NCc2coc3ccccc23)c1 159796172 HBNYHHFIQPKJOM-UHFFFAOYSA-N 266.300 3.144 70 20 CGID CCCCCN(C(=O)c1cccc(=O)n1C)[C@H](C)CCC 161265575 DTWQBQGBIWMLDZ-CQSZACIVSA-N 292.423 3.206 70 20 CGID Cc1nc(C2(NCc3ccc(F)c(F)c3)CCCC2)no1 161370272 HFKZABRSOMTEJU-UHFFFAOYSA-N 293.317 3.215 70 20 CGID CCOc1cc(F)ccc1NC(=O)C[C@@H](C)SC 160137696 AMVXQONIWJHPOM-SECBINFHSA-N 271.357 3.305 70 20 CGID CSCCCCC(=O)N[C@@H]1CCOC2(CCCC2)C1 160139346 BJLHZCKXJFJHSE-CYBMUJFWSA-N 285.453 3.128 70 20 CGID CC[C@H](NC(=O)c1cc(F)cc(F)c1)c1c(C)noc1C 160275163 SVPPIZKHLSUVAS-ZDUSSCGKSA-N 294.301 3.451 70 20 CGID Cc1cc2c(N[C@@H]3CCO[C@@H](C4CC4)C3)ncnc2s1 160357662 NYBVFAQSLXWOFC-DGCLKSJQSA-N 289.404 3.369 70 20 CGID CCCC(CCC)S(=O)(=O)Cc1c(CC)noc1C 160368253 YDLULEOXDFLWAQ-UHFFFAOYSA-N 287.425 3.429 70 20 CGID CCCC1(CNC(=O)c2c(C)nn(CC)c2Cl)CC1 160735209 XXVPWEDEBPFVNY-UHFFFAOYSA-N 283.803 3.175 70 20 CGID CCC[C@H](Nc1cccc(OCCF)c1)C(=O)OCC 160888055 XLAXVSUZPPFVBT-AWEZNQCLSA-N 283.343 3.179 70 20 CGID C[C@@H]1CCCN(C(=O)[C@H](C)c2c(F)cccc2F)C1 160965496 PYLXUEJMFSRIGR-GHMZBOCLSA-N 267.319 3.327 70 20 CGID CCCCn1ncc(C(=O)N[C@@H]2CCCC[C@H]2C)c1C 159636880 JKNHUJKGEUJGTJ-IUODEOHRSA-N 277.412 3.300 70 20 CGID Cn1cc(NC(=O)C2CCC(C)(C)CC2)cc(Cl)c1=O 159367256 FYGBYINYVUMSHH-UHFFFAOYSA-N 296.798 3.194 70 20 CGID C[C@H](NC(=O)[C@H]1CCCC[C@H]1N)c1ccc(Cl)cc1 160005168 DCFOVEKSSRUARF-LEWSCRJBSA-N 280.799 3.035 70 20 CGID O=C(NCc1ccccc1F)Nc1cc(Cl)ccn1 217314058 QNDKHBZFFXKHNR-UHFFFAOYSA-N 279.702 3.196 70 20 CGID Cc1cccc(C(=O)Nc2ccnn2C(C)C)c1F 161419637 BZTFJQFXBNPWIB-UHFFFAOYSA-N 261.300 3.164 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H](C)C2CC2)n1 161263420 FEWJTPVXCOYNQB-SNVBAGLBSA-N 284.363 3.019 70 20 CGID O=C(CCSc1ccncc1)Nc1cc(F)cc(F)c1 160040081 CBFSNEPXRGLKGO-UHFFFAOYSA-N 294.326 3.481 70 20 CGID Cc1nc2ccccn2c1CN1CCN(C)c2ccccc21 160352113 LUIIMSPJEVYZCB-UHFFFAOYSA-N 292.386 3.099 70 20 CGID CSC[C@@H](CCO)N[C@@H](Cc1ccc(C)cc1)C(C)C 160394862 LJVICMQUHOVGNP-SJORKVTESA-N 295.492 3.266 70 20 CGID CCC[C@H](C)C(=O)N[C@@H](CC)c1c(C)noc1C 160484520 CTEAFERUUTYKOI-CABZTGNLSA-N 252.358 3.295 70 20 CGID CS[C@H](C)CC(=O)NC[C@@H](C)COCc1ccccc1 160903593 OIGOJJQPWSCSNQ-ZIAGYGMSSA-N 295.448 3.097 70 20 CGID Cc1ccsc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159580916 XTAPOQGAOIEESW-BNOWGMLFSA-N 263.406 3.104 70 20 CGID c1coc(-c2noc(CN3CC[C@@H]4CCCC[C@@H]43)n2)c1 159697448 BYKLWIFSRKLICH-RYUDHWBXSA-N 273.336 3.094 70 20 CGID Cc1c(CNCc2ccc(C(C)(C)C)cc2)cnn1C 161306187 AKUUINKZYGJNFC-UHFFFAOYSA-N 271.408 3.316 70 20 CGID CC[C@@H](CSC)Nc1ncccc1Br 217377304 HWSIJBHEYUIBQZ-QMMMGPOBSA-N 275.215 3.398 70 20 CGID CCCCNC(=O)NCCCCCc1ccccc1 217962491 QMHSQBADOWMYLD-UHFFFAOYSA-N 262.397 3.499 70 20 CGID C[C@H]1CCC[C@]1(C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 864238861 QTSXSDRHAHNZPG-HZMBPMFUSA-N 299.367 3.110 70 20 CGID CCC1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CCCC1 776368493 WQYSTUGZHSWOBJ-UHFFFAOYSA-N 299.367 3.254 70 20 CGID CCCN(CCC)C(=O)c1cc(OC)c(OC)cc1F 161180465 FOIAJQCFMAELAG-UHFFFAOYSA-N 283.343 3.105 70 20 CGID Cc1cc(Cl)ccc1C(=O)NC[C@@H](O)C1CCCCC1 160240284 BYVIJHVJYHEZPT-OAHLLOKOSA-N 295.810 3.319 70 20 CGID CCCC1(CNC(=O)C2(c3ccccc3)CC2)CC1 160435793 ZVSSMFMXFYCUIV-UHFFFAOYSA-N 257.377 3.415 70 20 CGID CN(Cc1ccc(OC(F)F)cc1)Cc1ccn(C)c1 160622925 QWRMKPCRDYNKBU-UHFFFAOYSA-N 280.318 3.259 70 20 CGID COc1cccc(Cl)c1CC(=O)N[C@H]1C=CCCC1 160686692 JSQJZESVJDQKMX-NSHDSACASA-N 279.767 3.116 70 20 CGID O=C(NC1CC=CC1)C1(c2ccccc2)CCCC1 160901833 YNJUHSRHMLKSID-UHFFFAOYSA-N 255.361 3.333 70 20 CGID Cc1ccccc1NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 160928933 PHRVJTDQIUQRGP-ZFWWWQNUSA-N 274.364 3.074 70 20 CGID CC[C@@H](C)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159475173 BMZXNAKLTIYDCP-IJEWVQPXSA-N 275.392 3.317 70 20 CGID O=C(CCc1ccc(F)cc1F)NCC1(C2CC2)CC1 159937768 XTNNXJHHBMGGAR-UHFFFAOYSA-N 279.330 3.204 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc2ncccc2c1 159581468 SNQCRFYJHJCJJU-JTQLQIEISA-N 260.362 3.315 70 20 CGID C[C@H](C1CC1)N(Cc1ccccc1)Cc1csnn1 159682387 JQJKLVVBMZQMRR-GFCCVEGCSA-N 273.405 3.339 70 20 CGID CCC(CC)(CO)CN[C@@H](C)c1ccccc1OC 161323770 BGHCQRRILDECDJ-ZDUSSCGKSA-N 265.397 3.145 70 20 CGID CCCCC(=O)N1CCOc2ccc(Br)cc21 217258152 FRCQFTBKWMSBIB-UHFFFAOYSA-N 298.180 3.365 70 20 CGID CCc1ccc(/C=C/C(=O)N(CC(F)F)C(C)C)o1 161230721 MBAPAOFZUWBEMT-BQYQJAHWSA-N 271.307 3.357 70 20 CGID CCc1c(C(=O)N[C@H](C)CC(C)C)cnn1CC(C)C 161355977 APTNVPKSKHJZBA-CYBMUJFWSA-N 279.428 3.266 70 20 CGID Cc1cccc(C(=O)NCC2(N(C)C)CCCCC2)c1F 161399999 CQGPXPAGKPLMNG-UHFFFAOYSA-N 292.398 3.128 70 20 CGID CCc1ccc([C@H](C)NCCN(C)[C@@H](C)CC)o1 160152000 BFPGGAYQOHXYJC-STQMWFEESA-N 252.402 3.223 70 20 CGID COc1ccccc1CN(C)Cc1cccc2cn[nH]c12 160417633 DEXYIOSVVDWGNU-UHFFFAOYSA-N 281.359 3.204 70 20 CGID Cc1ccoc1C(=O)N[C@@H](C)CC(=O)c1cccs1 160769476 RSMKLLXLFGHKIH-JTQLQIEISA-N 277.345 3.041 70 20 CGID CN(Cc1ccc(-c2ccccc2)cc1)Cc1nncn1C 160782908 MJDJPJYKUOFAAL-UHFFFAOYSA-N 292.386 3.114 70 20 CGID CC[C@@H](COC)NCCCC(=O)Nc1ccc(Cl)cc1 160808534 WJXKHRNNYYLRPM-ZDUSSCGKSA-N 298.814 3.073 70 20 CGID CCCOc1cccc(CC(=O)NCC2(C3CC3)CC2)c1 159642701 KFHIISZWARNDLC-UHFFFAOYSA-N 287.403 3.324 70 20 CGID CC[C@H](C)OCC(=O)N(C)CCCOc1ccccc1C 159877747 KRFZQNCXLGCYBC-HNNXBMFYSA-N 293.407 3.037 70 20 CGID CCC[C@@H](Nc1ccn(CCC(C)C)n1)C(=O)OCC 159896030 TZYRRFNKCJISIL-CYBMUJFWSA-N 281.400 3.073 70 20 CGID C[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](C)C1CC1 159701694 SWEYIFPFEDYNRI-GHMZBOCLSA-N 265.784 3.433 70 20 CGID CC[C@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OC 159517393 GDLOTIQARIQGBP-SKDRFNHKSA-N 289.297 3.308 70 20 CGID Cn1ncc2c1CCC[C@H]2NC[C@@H]1CCc2ccccc21 161005878 NCABOFDQVJZGCC-WMLDXEAASA-N 281.403 3.117 70 20 CGID C[C@@H](CC(=O)N[C@@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCCNC1 161027766 VOEKJCJOSXGLKK-QMCVQRASSA-N 292.467 3.097 70 20 CGID CSc1ccsc1C(=O)N1[C@@H](C)CC[C@@H]1C 161497764 IGDWSVSPHIXECO-IUCAKERBSA-N 255.408 3.483 70 20 CGID CN(C(=O)CCSCCOCC1CC1)c1ccccc1 160137222 IPRXGYYXIAHSSD-UHFFFAOYSA-N 293.432 3.199 70 20 CGID CC(C)(C)c1nc(CCNC(=O)CC(F)(F)F)cs1 160648911 UCLLUDIJPXOTOQ-UHFFFAOYSA-N 294.342 3.052 70 20 CGID CC1CCC(NC(=O)[C@H](C)Sc2ccncc2)CC1 159882566 NAPMAHULWDBWBL-CPCZMJQVSA-N 278.421 3.257 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)CSCc1cccnc1 159514253 YJYNMLBQIKGULS-UONOGXRCSA-N 278.421 3.010 70 20 CGID Cc1nc(NC(=O)C[C@@H]2CC[C@H](C)C2)cc(C2CC2)n1 159955762 NCWVGCKTKNWXAR-CMPLNLGQSA-N 273.380 3.427 70 20 CGID CCOc1ccccc1N(C)Cc1nccn1C(F)F 159374240 PKFBXQKCVGBROC-UHFFFAOYSA-N 281.306 3.313 70 20 CGID CC(C)(C)SCC(=O)N[C@H]1CCCc2cc(N)ccc21 159365512 UDFWDGJAAQFPJX-AWEZNQCLSA-N 292.448 3.294 70 20 CGID O=C(NC[C@H]1CCCN1c1ccccc1)c1ccccc1F 217807444 WSCNAJOYMGOJPA-OAHLLOKOSA-N 298.361 3.225 70 20 CGID CC(C)C1(CNc2ccc(C(F)(F)F)nn2)CC1 218062714 GHLHMTASDRXSQA-UHFFFAOYSA-N 259.275 3.344 70 20 CGID CC[C@H](CSC)Nc1ncccc1Br 217377381 HWSIJBHEYUIBQZ-MRVPVSSYSA-N 275.215 3.398 70 20 CGID CC[C@H](C)CN(C)c1ccncc1Br 159952914 SYTOAQBSOJDCDW-VIFPVBQESA-N 257.175 3.326 70 20 CGID CN(C(=O)CNCC1CC1)c1ccc(-c2ccccc2)cc1 161082814 MZBUGAHJIXVEJZ-UHFFFAOYSA-N 294.398 3.316 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)Cc2ccccc2O)C1 161170580 LZLWNGDEKQMPJQ-AWEZNQCLSA-N 275.392 3.219 70 20 CGID CC(C)c1ccc(C(=O)Nc2cc(F)ccc2O)cn1 160007308 YIKSWUPOJGROMK-UHFFFAOYSA-N 274.295 3.302 70 20 CGID CCc1nc2c(s1)[C@@H](NCCN(C)[C@@H](C)CC)CCC2 160106795 LYIZSKMOBMHBLG-STQMWFEESA-N 295.496 3.403 70 20 CGID CCc1ccc([C@H](C)NC(=O)c2ccc(COC)o2)cc1 160139962 ZAHHEXYHKJPSIA-LBPRGKRZSA-N 287.359 3.479 70 20 CGID Cc1nc2ccccc2nc1N[C@@H]1CCO[C@H](C2CC2)C1 160404738 WKUWZLIWKORIDV-CJNGLKHVSA-N 283.375 3.308 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)C[C@H](CC)c1ccccc1 160414852 KHMFOICAQJEJKR-KBPBESRZSA-N 291.391 3.028 70 20 CGID CC(C)c1cc(=O)n(Cc2ccc(F)cc2Cl)cn1 160653141 YXYJIUNZWGEKPP-UHFFFAOYSA-N 280.730 3.208 70 20 CGID COCc1ccccc1NC(=O)N[C@@H](C)C1CCC1 160827390 XOZUEMHKQYLSJW-NSHDSACASA-N 262.353 3.143 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cnc(-c2ccccc2)nc1 159555452 QUDQSTIYNMWTBP-CZUORRHYSA-N 295.386 3.452 70 20 CGID CC[C@H](C)[C@@H](C)NC[C@@H](O)COc1cc(C)ccc1C 218778170 URMSHROIIAAAJR-NUEKZKHPSA-N 279.424 3.067 70 20 CGID COc1ccc(NC(=O)c2cc(C)c(F)c(C)c2)cn1 160375201 PYJCXUOXGZMNDK-UHFFFAOYSA-N 274.295 3.098 70 20 CGID CCc1ccc(OS(=O)(=O)c2cc(F)cc(F)c2)cc1 217055113 RVGKIVBQLXKREL-UHFFFAOYSA-N 298.310 3.295 70 20 CGID C[C@@H]1CCC[C@@H](CNC(=O)N2CCC[C@@H](C)C2)C1 218050854 DWAOAXXMUZAWIR-MGPQQGTHSA-N 252.402 3.254 70 20 CGID COC[C@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)C1CC1 161284316 DGBJLQJNVGJAHS-NHYWBVRUSA-N 295.810 3.060 70 20 CGID CCO[C@@H]1C[C@@H](NCC2(CO)CCCC2)C12CCCCC2 160101025 RFFKCYZCHQYASM-HZPDHXFCSA-N 295.467 3.257 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)N(C)Cc1ccncc1 160336756 UESBNHFAJDBONE-ZIAGYGMSSA-N 286.400 3.214 70 20 CGID Cc1ccc(CCNC(=O)C[C@@H](C)c2ccncc2)cc1 160454130 KZYSJQKFAHEECB-OAHLLOKOSA-N 282.387 3.243 70 20 CGID CC[C@H](NC(=O)C[C@H]1CCCN1)C(C)(C)c1ccccc1 160763050 WBBFIBXCEMNCEU-CVEARBPZSA-N 288.435 3.001 70 20 CGID CC1(C)C[C@@H](NC(=O)Nc2ccc(F)c(F)c2)CCO1 160813850 ORAIQDKUQYQDEH-JTQLQIEISA-N 284.306 3.044 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccnn1Cc1ccccc1 159844912 VPBNSEINBRJWPY-PBHICJAKSA-N 283.375 3.306 70 20 CGID Cc1c(C(=O)Nc2cccc(F)c2F)cnn1CC(C)C 159667101 OJHLNGVCSIKVSP-UHFFFAOYSA-N 293.317 3.378 70 20 CGID CC(C)CCn1ccc(NC(=O)N2C[C@H]3CCC[C@H]3C2)n1 159674686 NWBZMNLOUIPOLV-OKILXGFUSA-N 290.411 3.193 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCc1ccco1 159690412 YROHLFKUKIONKG-STQMWFEESA-N 275.373 3.112 70 20 CGID CCCc1noc(CSCc2c(CC)noc2C)n1 159714790 FWCVUJWLQVXEDL-UHFFFAOYSA-N 281.381 3.314 70 20 CGID CC[C@@H]1C[C@H](Nc2ccc(F)c(OC)c2)CCO1 159967110 YQSYSJVLYUOSFY-VXGBXAGGSA-N 253.317 3.204 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(C)cc1F 159976907 VAZXLINTTOLLQY-UHFFFAOYSA-N 282.359 3.054 70 20 CGID CCOC(=O)[C@@H]1CCCN(Cc2cc(Cl)ccc2F)C1 218306044 ILWWEPMFRHIJFL-LLVKDONJSA-N 299.773 3.254 70 20 CGID CCOC(=O)[C@H](NC1CCC(C)CC1)c1ccccc1 217684908 BJQZFLITSUNSMM-AVVWSFFYSA-N 275.392 3.459 70 20 CGID CCCc1sc(C(=O)N[C@@H]2CCC[C@@H](N)C2)cc1CC 161145134 KEXNEZSAUUMOTL-CHWSQXEVSA-N 294.464 3.263 70 20 CGID c1ccc2c(OCc3nnc4n3CCCC4)cccc2c1 217323336 MIAFNEWOUDFIIR-UHFFFAOYSA-N 279.343 3.347 70 20 CGID CC[C@H](C)[C@@H](C)NC(=O)c1ccc(N(C)C)cc1F 161056174 MFBFRNYHULDZER-WDEREUQCSA-N 266.360 3.056 70 20 CGID O=C(NC1CC=CC1)C1(c2cccc(F)c2)CCCC1 161076800 LJEWHQNLFCINRW-UHFFFAOYSA-N 273.351 3.472 70 20 CGID Cc1cc(C(=O)N[C@@H](C)c2cccc3ccccc23)ncn1 161251940 AGNSUTURUSHLGL-ZDUSSCGKSA-N 291.354 3.429 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1cnc2cc(F)c(F)cc2n1 161425130 SCROVHCILQVTQT-VIFPVBQESA-N 295.333 3.117 70 20 CGID CCc1ccccc1C(=O)N(C)CCC(F)(F)F 160029344 NPHSCYYJQNZNIJ-UHFFFAOYSA-N 259.271 3.273 70 20 CGID c1ccc2oc(N3CCC[C@H]3CN3CCCCC3)nc2c1 160449585 CYMPSCRCDGWSHC-AWEZNQCLSA-N 285.391 3.283 70 20 CGID CCCCn1nccc1NC(=O)C[C@H](C)c1ccncc1 159915014 FFNSMHIKAMUISN-ZDUSSCGKSA-N 286.379 3.211 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)Oc1cccc(F)c1 159726026 PXDFVRGXDHDPCS-JMSVASOKSA-N 279.355 3.288 70 20 CGID CCCn1nccc1CNc1ccc(N(C)C)cc1C 160010871 MLGUJQQAUSRRDP-UHFFFAOYSA-N 272.396 3.280 70 20 CGID COc1ccc(CN(Cc2ccccc2)C(C)=O)cc1 218645805 TYFLOMPMTFDKEN-UHFFFAOYSA-N 269.344 3.244 70 20 CGID CC(=O)NCCCN(c1cc(C)ccc1C)C(C)C 160731866 UQOKRBPJSQHSQU-UHFFFAOYSA-N 262.397 3.044 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cccnc1OC 161161158 PZCTZJZDODRZOB-GXTWGEPZSA-N 276.380 3.131 70 20 CGID CO[C@@H](C(=O)N1CCC[C@@H]1c1ccncc1)c1ccccc1 161302441 QTXLBAAZMIAHTC-IAGOWNOFSA-N 296.370 3.133 70 20 CGID Cc1ccc(NC(=O)NCc2cc3ccccc3[nH]2)cn1 161366465 MSTOBFASAMOJQK-UHFFFAOYSA-N 280.331 3.193 70 20 CGID FC(F)(F)c1ccc(NCc2cccc3c2OCO3)cn1 160064229 DODDHAZSWCIKCB-UHFFFAOYSA-N 296.248 3.441 70 20 CGID C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1cccc(F)n1 160221817 FOWFDNXJRLWPLU-HIFRSBDPSA-N 285.366 3.153 70 20 CGID O=C(CCSc1ccccc1)NCC1(C2CC2)CC1 160226407 GSULOMLGMPTNII-UHFFFAOYSA-N 275.417 3.475 70 20 CGID CC[C@H](C)[C@H](C)NCc1ccccc1CN1CCOCC1 160428206 ATXFYZGWUQLBEJ-HOTGVXAUSA-N 290.451 3.043 70 20 CGID COc1ccc2ccccc2c1CNC(=O)[C@@H]1CCCCO1 160881508 LXKZVDYCDBYJPG-KRWDZBQOSA-N 299.370 3.034 70 20 CGID CCc1noc(C)c1CNc1cccc(OCCOC)c1 159405934 KAKXPZSLFHGLRN-UHFFFAOYSA-N 290.363 3.183 70 20 CGID CC(C)c1ccc([C@@H](C)CC(=O)NCc2ncc[nH]2)cc1 159865084 OQUUCXDPUAVCDA-ZDUSSCGKSA-N 285.391 3.343 70 20 CGID CC[C@H](C)[C@H](C)N(C(=O)NCCc1cscn1)C1CC1 159551711 TWFAHKICDQGPIQ-RYUDHWBXSA-N 295.452 3.294 70 20 CGID CCCC(O)(CCC)CNC(=O)c1ccc(C(C)C)nc1 159760943 HNRMIWLPJDKPQL-UHFFFAOYSA-N 292.423 3.266 70 20 CGID Cc1cccc(C(=O)N[C@H](CO)c2ccccc2)c1Cl 160380565 SXHDBCYVLOSNOB-CQSZACIVSA-N 289.762 3.112 70 20 CGID C[C@H](CNCc1ccc(Cl)cc1F)CN1CCCC1 160820393 KQMCGUQBUIGPDL-GFCCVEGCSA-N 284.806 3.301 70 20 CGID C[C@@H](CNCc1cc(F)cc(Cl)c1)CN1CCCC1 160935056 PKHYUGFEQOCRFF-LBPRGKRZSA-N 284.806 3.301 70 20 CGID c1ccc2c(CNCCCCn3ccnc3)coc2c1 161098741 HLFFSAWOFSBACJ-UHFFFAOYSA-N 269.348 3.199 70 20 CGID Cc1cccc(C(=O)N(C)Cc2ccccc2)c1F 161385487 FEHXAKBJIJOUFK-UHFFFAOYSA-N 257.308 3.406 70 20 CGID O=S(=O)(Cl)Cc1cccc(OCc2ccccc2)c1 216366123 PHOPVEFKAFEWNW-UHFFFAOYSA-N 296.775 3.334 70 20 CGID O=S(=O)(Cl)Cc1cc(Cl)ccc1OC(F)F 106524803 DUPLFBNAUPMLDO-UHFFFAOYSA-N 291.102 3.010 70 20 CGID CC(C)COc1cccc(NC(=O)N[C@@]2(C)CCOC2)c1 161356888 SYXXWIMOOWTVMF-INIZCTEOSA-N 292.379 3.022 70 20 CGID CCC(CC)(CC)CNC(=O)N1CC[C@]2(CCOC2)C1 160022970 ZQIIGJAERPNPBJ-INIZCTEOSA-N 282.428 3.025 70 20 CGID CCC(CC)(CC)CNC(=O)N1CC[C@@]2(CCOC2)C1 160023094 ZQIIGJAERPNPBJ-MRXNPFEDSA-N 282.428 3.025 70 20 CGID CCc1ncc(C(=O)N[C@@H](CC)c2c(C)noc2C)s1 160023936 YHIFCKKJHIJARD-JTQLQIEISA-N 293.392 3.191 70 20 CGID CCCc1noc(CN2CCC[C@@H]2c2cccc(C)n2)n1 160123780 YFCOIGQPVWZXHT-CQSZACIVSA-N 286.379 3.063 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2nnc(C(C)C)o2)n1 160384841 NBPRXHJXWUWPHY-AWEZNQCLSA-N 286.379 3.234 70 20 CGID Brc1ccc(N[C@H]2CCO[C@@H](C3CC3)C2)nc1 160469079 YPGQFJURZVQSCN-NWDGAFQWSA-N 297.196 3.214 70 20 CGID CC1CCC(N(C)C(=O)N[C@H]2CCO[C@H](C3CC3)C2)CC1 160505469 RIEDYSPEGRQWBD-LVBITLCTSA-N 294.439 3.164 70 20 CGID CC(C)[C@H](C)N(C(=O)N[C@H]1CCO[C@H](C2CC2)C1)C1CC1 160624714 XJERCGUZJMZTQR-NOLJZWGESA-N 294.439 3.163 70 20 CGID Cc1cnc(CNC(=O)C2CCC(C)(C)CC2)s1 160732653 UWTCJYSVIULPDS-UHFFFAOYSA-N 266.410 3.284 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)cc1C 160936406 ZLXCXHJSLOXBJG-JKSUJKDBSA-N 288.391 3.383 70 20 CGID CSc1cc(C(=O)N(C)Cc2cscn2)ccc1F 160973707 GKJJLNUINBMMHK-UHFFFAOYSA-N 296.392 3.276 70 20 CGID CCc1noc(C)c1CNc1cc(C)ccc1NC(C)=O 159438144 ADQLCFPALJVYQK-UHFFFAOYSA-N 287.363 3.424 70 20 CGID O=C(NCC1(Cc2ccccc2)CC1)NC1CC=CC1 159369838 XNJCINPQBWPRTO-UHFFFAOYSA-N 270.376 3.027 70 20 CGID Cc1cccc(CCNC(=O)Nc2ccc(Cl)cn2)c1 217415082 HREIORMHXAITBN-UHFFFAOYSA-N 289.766 3.408 70 20 CGID Cc1cc(CNc2cc(F)ccc2Br)no1 159583956 JSGQXGAIRKIEBW-UHFFFAOYSA-N 285.116 3.497 70 20 CGID CC1(C)C[C@H]1C(=O)NCc1ccc(Br)cc1 160091530 JVIJIWWFWIZMED-NSHDSACASA-N 282.181 3.111 70 20 CGID CCC[C@H](COCc1ccccc1)CS(=O)(=O)Cl 114476502 IVRZGSHCMWMRHF-CYBMUJFWSA-N 290.812 3.188 70 20 CGID COCCC1(CNC(=O)N2CCCC[C@H]2CC(C)C)CC1 161033067 WESSOMSCWGAFND-HNNXBMFYSA-N 296.455 3.413 70 20 CGID CCOCCC1(C(=O)N(C)Cc2ccccc2)CCC1 161133732 YTYVTDYNHQWOCY-UHFFFAOYSA-N 275.392 3.242 70 20 CGID CC(C)C1CCN(C(=O)[C@@H](C)[C@H](N)c2ccccc2)CC1 161268804 FWMDAZDAAJMDJR-YOEHRIQHSA-N 288.435 3.217 70 20 CGID CC[C@H](S[C@H](CC)c1ccc(F)cc1)C(N)=O 161339371 JYUJCWYGIBBROR-NEPJUHHUSA-N 255.358 3.274 70 20 CGID C[C@H]1CC[C@H](C)N1c1cnc2cc(F)c(F)cc2n1 161447118 UCOYEQUSECFPFM-IUCAKERBSA-N 263.291 3.285 70 20 CGID Cc1cccn2c(CN(C)Cc3cccc(F)c3)cnc12 160465482 RBMDEEKRSRROLB-UHFFFAOYSA-N 283.350 3.414 70 20 CGID C[C@@H](CC(=O)N[C@@H]1CCCSC1)c1ccc(F)cc1F 160828798 ABTXYFURVHBOSE-CMPLNLGQSA-N 299.386 3.470 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccn(-c2ccccc2)n1 160838396 MVASWRCLUPLMIV-CZUORRHYSA-N 269.348 3.247 70 20 CGID CC[C@H](C)[C@@H](N)C(=O)Nc1sc2c(c1C)CCCC2 160988417 RLOZQVKAOIOORS-TVQRCGJNSA-N 280.437 3.247 70 20 CGID O=C(Nc1nc(-c2cccs2)cs1)[C@@H]1CCCCO1 159670831 RWFUEMODJMYFDO-JTQLQIEISA-N 294.401 3.379 70 20 CGID Cc1ccsc1CCCC(=O)Nc1c[nH]c(=O)c(C)c1 159491727 JJIOYDPODJGOLC-UHFFFAOYSA-N 290.388 3.015 70 20 CGID CCOc1cccc(CNc2ncnc(CC)c2F)c1 217976540 XROMBEYOZWGEHA-UHFFFAOYSA-N 275.327 3.189 70 20 CGID CCSCC[C@H](C)NC[C@@H](O)c1ccc(F)cc1F 160170936 HVWJAMWFELQGRO-IINYFYTJSA-N 289.391 3.120 70 20 CGID C/C(=C/C(=O)Nc1ccc(S(=O)(=O)F)cc1)C(C)(C)C 776364004 OHNMWFWTDVBEGP-KTKRTIGZSA-N 299.367 3.276 70 20 CGID Cc1nnc(CSc2nc3cc(Cl)ccc3o2)n1C 160957181 INWIWHJVLFDXME-UHFFFAOYSA-N 294.767 3.210 70 20 CGID COCCC1(CNC(=O)N(C)[C@H]2CCC[C@@H](C)C2)CC1 161028031 KRGCZIDPPUAWMJ-KGLIPLIRSA-N 282.428 3.023 70 20 CGID CCOCCC1(C(=O)Nc2ccccc2F)CCC1 161060263 WNNIPDZTQLTEAN-UHFFFAOYSA-N 265.328 3.361 70 20 CGID CN(C)[C@H]1CCC[C@H](N[C@@H]2CCCOc3ccccc32)C1 161091759 LEKPSWFVYIVIEN-YQQAZPJKSA-N 288.435 3.363 70 20 CGID COC(=O)c1cc(CN(C)Cc2cccc(Cl)c2)c[nH]1 161132684 WTQMROHHHOSKQP-UHFFFAOYSA-N 292.766 3.087 70 20 CGID CC(C)[C@H](CNC(=O)[C@@H]1CCCCO1)c1ccccc1 161429277 AOSXWAQHAPDRPX-HOTGVXAUSA-N 275.392 3.112 70 20 CGID Cc1cc(CNC(=O)C[C@H]2CCCCC2(C)C)on1 161433498 OQMJHSYNZPADQP-GFCCVEGCSA-N 264.369 3.206 70 20 CGID Cc1cnccc1CCNc1nc(C(C)(C)C)ns1 160111327 UWIPTXBVPJTBJV-UHFFFAOYSA-N 276.409 3.194 70 20 CGID CCc1ccc(CC(=O)N(C)c2ccc3c(c2)OCO3)cc1 160169821 XKFNQJWSXDUAQQ-UHFFFAOYSA-N 297.354 3.183 70 20 CGID CCCCn1ncc(NC(=O)N2CCC[C@H]2C)c1C 160260386 HHNPNLJVMUNKEV-LLVKDONJSA-N 264.373 3.008 70 20 CGID Cc1cnc(N[C@H]2CCO[C@@H](c3ccccc3)C2)nc1 160574476 SSHTVSNLRTVQIH-LSDHHAIUSA-N 269.348 3.117 70 20 CGID CCC(C)(CC)C(=O)Nc1ccn(CC(F)(F)F)n1 159498999 SVRIXJRHHMZXCC-UHFFFAOYSA-N 277.290 3.210 70 20 CGID O=C(CC1CCOCC1)N[C@H]1CCCc2sccc21 159941342 RSBADLSQRVECHL-ZDUSSCGKSA-N 279.405 3.058 70 20 CGID CC[C@H](C)N(C)CCNc1ncnc2sc(C)c(C)c12 217366392 SSZPMYHCQMIXRK-JTQLQIEISA-N 292.452 3.450 70 20 CGID CN(CCNCc1ccc(Cl)cc1F)C1CCCC1 160822142 PTBQRANIXMZNCE-UHFFFAOYSA-N 284.806 3.443 70 20 CGID CN(C)[C@@H](CNCc1cccc2cc[nH]c12)c1ccco1 218067574 RAHHXUHHAAZKBW-HNNXBMFYSA-N 283.375 3.153 70 20 CGID C[C@@H]1CC=CC[C@@H]1COC(=O)Cc1ccsc1 218498616 BOZYGRWRYXHANC-DGCLKSJQSA-N 250.363 3.436 70 20 CGID C[C@@H](CN[C@H](C)C1(C)CC1)N(C)Cc1ccccc1 160884007 BHLILOHZNXTQLV-LSDHHAIUSA-N 260.425 3.285 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1ccc(C)cc1C 161040201 MEYAMKFVWBZAOF-IBGZPJMESA-N 277.389 3.470 70 20 CGID CCOc1ccc(Cl)cc1CCN[C@@H](C)CCOC 160006084 AAYJCTWXRBGYFY-LBPRGKRZSA-N 285.815 3.296 70 20 CGID O=C(COC/C=C/c1ccccc1)NCC1(C2CC2)CC1 160018078 ZUPTXMWTRACECW-QPJJXVBHSA-N 285.387 3.023 70 20 CGID O=C(CC[C@@H]1CCOC1)N[C@H]1CCCc2sccc21 160092210 CFQPPKFXVONPCX-YPMHNXCESA-N 279.405 3.058 70 20 CGID C[C@H]1CCCN1[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 160097708 FDUFBCXOERTYKD-IINYFYTJSA-N 296.773 3.069 70 20 CGID CCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1ccn(C)c1 160244688 XZVBBWYRJFNNKE-CQSZACIVSA-N 289.766 3.265 70 20 CGID CCc1nc2cc(NC(=O)C[C@@H](C)SC)ccc2o1 160377877 STNIFRGFIOWDIO-SECBINFHSA-N 278.377 3.470 70 20 CGID CCOc1cccc(NC(=O)C[C@H](C)SC)c1 160491835 NPBQPMJXBNMTHL-JTQLQIEISA-N 253.367 3.165 70 20 CGID CC[C@H](N[C@@H](C)C(=O)OC(C)(C)C)c1nc(C)cs1 160889499 GVHCQDKHZXFSNX-QWRGUYRKSA-N 284.425 3.222 70 20 CGID CCCCN1CCOc2ccc(Br)cc21 217240229 WABPAOZWPXZWNF-UHFFFAOYSA-N 270.170 3.448 70 20 CGID O=C(NCCc1cccc(F)c1)NCc1cccc(F)c1 217314812 KRESUYDKSUJHFF-UHFFFAOYSA-N 290.313 3.007 70 20 CGID CCOC(=O)CN[C@H](c1ccc(F)cc1)C(C)(C)C 159553418 OCMTVYSWTDKDJR-CQSZACIVSA-N 267.344 3.066 70 20 CGID O=C(C[C@H]1C=CCCC1)Nc1cccc(S(=O)(=O)F)c1 809281406 WUGRXIGLHKQWLS-NSHDSACASA-N 297.351 3.030 70 20 CGID CC(C)CNC[C@H]1CCCCN1C(=O)OC(C)(C)C 218096099 VVEUQGUJPRMMSO-CYBMUJFWSA-N 270.417 3.022 70 20 CGID CC(C)COc1ccccc1NC(=O)N[C@]1(C)CCOC1 161415434 INUWTZULUAXCCO-MRXNPFEDSA-N 292.379 3.022 70 20 CGID CC[C@H](CSC)N(C)c1nc(C(C)(C)C)ns1 160267836 QGGNQFMHTRVHFJ-SECBINFHSA-N 273.471 3.413 70 20 CGID CC[C@H](Oc1ccccc1F)C(=O)NCC1(C2CC2)CC1 160014637 JPJNSROKYWXXIS-AWEZNQCLSA-N 291.366 3.290 70 20 CGID Cc1cc(C(=O)NCCc2cccc(O)c2)sc1C 160162269 AUWLHFRLDPUACB-UHFFFAOYSA-N 275.373 3.043 70 20 CGID CCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1ccn(C)c1 160244811 XZVBBWYRJFNNKE-AWEZNQCLSA-N 289.766 3.265 70 20 CGID c1ccc2oc(N3CCC[C@@H]3CN3CCCCC3)nc2c1 160449446 CYMPSCRCDGWSHC-CQSZACIVSA-N 285.391 3.283 70 20 CGID Cc1cccc(-c2[nH]ncc2CN[C@H]2CCOC(C)(C)C2)c1 160632856 RPGIQZCPLOIIDQ-INIZCTEOSA-N 299.418 3.432 70 20 CGID COC[C@@H]1CCCN1C(=O)C[C@H]1CCCCC1(C)C 160883583 YLYGIJJFWYQAOZ-KGLIPLIRSA-N 267.413 3.230 70 20 CGID O=C(Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCCO1 159413230 JRVBOUGIZZRXRK-NSHDSACASA-N 289.253 3.093 70 20 CGID CCOC(=O)CCc1ccc(NC(=O)N(CC)CC)cc1 159635357 FWXRSFOJARYKQH-UHFFFAOYSA-N 292.379 3.056 70 20 CGID Cc1cc(F)c(C(=O)NCCc2ccccc2F)cc1F 159845935 DLTLQGFJPDGFFC-UHFFFAOYSA-N 293.288 3.385 70 20 CGID CC[C@@H](COC)NC(=O)NC1(c2ccc(Cl)cc2)CC1 159758977 XBBYIWBQZKRYGM-ZDUSSCGKSA-N 296.798 3.053 70 20 CGID O=S(=O)(Cl)CCc1cc(Cl)cc(Cl)c1 106937486 LJXKDZUMRRPIPS-UHFFFAOYSA-N 273.568 3.105 70 20 CGID CC1(C)C[C@@H](NCc2csc(C(C)(C)C)n2)CCO1 159779268 CJFZKPIMYUUQIG-NSHDSACASA-N 282.453 3.488 70 20 CGID C/C(=C\C(=O)Nc1cccc(S(=O)(=O)F)c1)C(C)(C)C 809282761 ZVNIBSUDODPDRS-CSKARUKUSA-N 299.367 3.276 70 20 CGID COc1ccc(N(C)C(=O)CCCCSC)cc1F 159721361 WIGBRIJVVHSOQW-UHFFFAOYSA-N 285.384 3.330 70 20 CGID CCOc1cc(C)ccc1NC1CCC(NC(C)=O)CC1 161143206 WFYWVXSYXFYXJL-UHFFFAOYSA-N 290.407 3.253 70 20 CGID CC[C@H](Cc1ccccc1)N(CC)C(=O)CC1(N)CCC1 161437417 GOLAQWFSGGAMGQ-MRXNPFEDSA-N 288.435 3.128 70 20 CGID C[C@@H](NCc1csc(-c2ccccc2)n1)c1cnccn1 161485258 FKWTUMVNMIDVLS-GFCCVEGCSA-N 296.399 3.451 70 20 CGID COc1cc([C@@H](C)NC2CCN(C)CC2)ccc1SC 161501912 SBLIWZCXFWNJGJ-GFCCVEGCSA-N 294.464 3.162 70 20 CGID Cc1ncccc1C(=O)N[C@@H]1CCCc2sccc21 160033858 PKXQPNXGUDZNMY-CYBMUJFWSA-N 272.373 3.259 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)c2cccc(C)n2)o1 160083540 NEKRTQPCJFEAOJ-ZHACJKMWSA-N 270.332 3.222 70 20 CGID COC[C@H](Cc1ccccc1)N[C@H](C)c1ccco1 160196798 PSYFVYHHRYWTNH-HIFRSBDPSA-N 259.349 3.188 70 20 CGID CC(=O)Nc1cccc([C@H](C)NC[C@@H]2CCC(C)(C)O2)c1 160223419 LTSNVTMEUBMCEH-LRDDRELGSA-N 290.407 3.253 70 20 CGID CSC[C@H](CCO)N[C@H](C)c1ccc(OC(C)C)cc1 160323698 WAJUSBUXIMPIAP-HIFRSBDPSA-N 297.464 3.238 70 20 CGID CCOc1cc(CN[C@H]2CCOC(C)(C)C2)ccc1OC 160552758 QFMILKFTYVLCJB-AWEZNQCLSA-N 293.407 3.141 70 20 CGID Cc1cc(C)nc(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160577548 IWJIGZXMEHQNQP-JKSUJKDBSA-N 283.375 3.426 70 20 CGID Cc1noc(C)c1C(=O)N1CC(C)(C)Oc2ccccc21 160815273 JFKWOTXHJXJBSD-UHFFFAOYSA-N 286.331 3.109 70 20 CGID Cc1ccc(NC(=O)NCCCC(=O)OC(C)C)cc1C 160937917 YSDCWAIHLYGJRI-UHFFFAOYSA-N 292.379 3.157 70 20 CGID CCSCC[C@H](C)N(C)C(=O)c1cccc2[nH]cnc12 159765788 IWXMYLLZDNOBHW-NSHDSACASA-N 291.420 3.167 70 20 CGID CNC[C@H](C)C(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 159781710 HBDRCDHCJJYYAE-HLLBOEOZSA-N 288.435 3.150 70 20 CGID CCS[C@@H]1CCC[C@H]1NC(=O)CCCn1cccc1 159797719 GNQLVWAZVWGZJF-ZIAGYGMSSA-N 280.437 3.059 70 20 CGID c1ccc(C2CC(N[C@@H]3CCN4CCCC[C@@H]34)C2)cc1 217690448 SXXYVJRSMPFUPQ-HIEASXQVSA-N 270.420 3.149 70 20 CGID C[C@H](CN[C@H]1CCN2CCCC[C@@H]12)c1ccccc1 217631027 CCULJWMTQSQBTH-PVAVHDDUSA-N 258.409 3.007 70 20 CGID Fc1cc(OCCOC[C@H]2CCCO2)ccc1Cl 161113274 GWRIYHINLZRCJN-LLVKDONJSA-N 274.719 3.054 70 20 CGID CC[C@H](C)[C@@H](C)NC(=O)NCCc1ccc(C)cc1 217224321 NCVLYTCVPISPHG-UONOGXRCSA-N 262.397 3.271 70 20 CGID CCc1ncsc1NC(=O)C[C@@H](C)c1c(C)noc1C 161028758 QKLADKYSRTZYFM-MRVPVSSYSA-N 293.392 3.443 70 20 CGID CC(C)CCn1ccc(NC(=O)N2C[C@@H](C)C[C@H](C)C2)n1 161404138 CQTGFGMCINDKHK-KBPBESRZSA-N 292.427 3.439 70 20 CGID Cc1cccc(Cn2nc(C3CC3)nc2C2CC2)c1 161463492 DCCBXIYWCQWZCZ-UHFFFAOYSA-N 253.349 3.390 70 20 CGID CC(C)[C@H](NC(=O)[C@H]1CCCCO1)c1ccccc1 160232669 NYWDBUGYPAKWAG-CABCVRRESA-N 261.365 3.069 70 20 CGID CC1(C)C[C@H]1C(=O)N1CCn2cccc2[C@@H]1c1ccccc1 160476824 ADZQKVVLNWDYKT-RDJZCZTQSA-N 294.398 3.466 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CC[C@H](C)c1ccccc1 160709614 OXWSLMTYWCNLOV-HOCLYGCPSA-N 277.408 3.094 70 20 CGID Cc1cccc([C@@H](C)CNC(=O)CNc2ccccc2)c1 160734343 ORGVZJFEURDLLQ-HNNXBMFYSA-N 282.387 3.327 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccnc(N(C)C)c1 160925610 IDXFQHRQUDFAJD-ZFWWWQNUSA-N 289.423 3.188 70 20 CGID Clc1ccccc1C[C@H]1CCCN1CCn1ccnc1 159774262 YFVDANGYSNKYQN-OAHLLOKOSA-N 289.810 3.244 70 20 CGID Cc1ccc(C(=O)N2CCS[C@H]3CCCC[C@H]32)cc1N 161430863 HVAJYLVPTWRXMR-CABCVRRESA-N 290.432 3.077 70 20 CGID COc1ccc([C@H](C)NC(=O)NCc2cccs2)cc1 217301407 XZMVTXZJTGXTBI-NSHDSACASA-N 290.388 3.317 70 20 CGID OCc1ccc(Sc2nc(Cl)cs2)cc1 160458112 QADNOXMWQMWIJB-UHFFFAOYSA-N 257.767 3.440 70 20 CGID c1cc(-c2nc(CN(CC3CC3)CC3CC3)no2)cs1 160886999 SSDAENBYTVDJRC-UHFFFAOYSA-N 289.404 3.420 70 20 CGID C[C@@H]1CCCC[C@H]1NC(=O)c1ccnc(Cl)c1F 160881754 YESIMVGPCYTPRH-PSASIEDQSA-N 270.735 3.183 70 20 CGID CCC(=CC(=O)Nc1sccc1C(=O)NC1CC1)CC 161010243 VMQQZPMBKDEWHB-UHFFFAOYSA-N 292.404 3.325 70 20 CGID C[C@H](NC(=O)N[C@H]1CCOC(C)(C)C1)c1ccccc1 161100652 NBALLTBLJOSYPC-JSGCOSHPSA-N 276.380 3.004 70 20 CGID Cc1ccc(-n2cnnc2SCCCCCO)c(C)c1 161394083 OTULEDWRBHLALI-UHFFFAOYSA-N 291.420 3.139 70 20 CGID CCOc1ccc(NC(=O)N(C)[C@@H]2CCSC2)cc1F 161456374 PTNLCTJKDSJYPI-LLVKDONJSA-N 298.383 3.194 70 20 CGID CC[C@H](COC)NCCSc1ccc(Cl)cc1 160085739 LUUMOILHXOBKOO-GFCCVEGCSA-N 273.829 3.447 70 20 CGID COc1ccc(C)nc1NC(=O)N1CCCC[C@H]1C(C)C 160459538 OOWWUSDZGRJFSP-ZDUSSCGKSA-N 291.395 3.441 70 20 CGID CC[C@@H](C)N(C)CCNC(=O)c1ccc(F)c(SC)c1 160501211 NHUKPIXRPFMSNM-LLVKDONJSA-N 298.427 3.008 70 20 CGID Cc1ccc(-c2n[nH]cc2CN[C@@H]2CCOC(C)(C)C2)cc1 160554338 PGGWWKGKQBDGKJ-MRXNPFEDSA-N 299.418 3.432 70 20 CGID CC1(C(=O)N[C@H]2CCOC3(CCCCC3)C2)CCC1 160643440 MXDRJRGFARVKOX-ZDUSSCGKSA-N 265.397 3.175 70 20 CGID CSc1cccc(NC(=O)N[C@H]2CCOC(C)(C)C2)c1 160704623 IZQGKGWDMOABBA-LBPRGKRZSA-N 294.420 3.488 70 20 CGID CCc1nc([C@H](C)N[C@H](C)C(=O)OC(C)(C)C)cs1 160905083 UYTMUVYQTZEFSN-VHSXEESVSA-N 284.425 3.086 70 20 CGID CN(C(=O)Nc1ccc(Cl)cc1F)[C@H]1CCSC1 159400385 XAPKWQABKOYGEL-VIFPVBQESA-N 288.775 3.448 70 20 CGID Cc1ccccc1[C@@H](CC(C)C)NC(=O)[C@H]1CCCNC1 159693953 WXYLECHYZVPIEA-DOTOQJQBSA-N 288.435 3.198 70 20 CGID CC1=C(C(=O)N(C)Cc2ccc(Cl)s2)CCCO1 159528529 GVVIMRUAJRQKGG-UHFFFAOYSA-N 285.796 3.444 70 20 CGID CC[C@@H](O)[C@H]1CCCCN1CCC(=O)c1ccc(C)cc1 159763699 BDEHNURFLMUXKD-IAGOWNOFSA-N 289.419 3.193 70 20 CGID C[C@@H](C[C@H](O)c1ccco1)Nc1nc(C(C)(C)C)ns1 159960621 JGORHCXONLMJRC-UWVGGRQHSA-N 295.408 3.353 70 20 CGID O=C(NCCc1ccco1)C1(Cc2ccccc2)CCC1 159797030 QMQAPFDYEHAJLT-UHFFFAOYSA-N 283.371 3.351 70 20 CGID CC[C@@H](C)N(C)CCNCc1cc(C)c(C)cc1C 217373745 JAAZZRDRYJLEAO-MRXNPFEDSA-N 262.441 3.432 70 20 CGID Cc1cccc([C@@H](C)N[C@@H](C)c2cn(C)nc2C)c1 160136412 NDNQDPDLFYKMNH-OLZOCXBDSA-N 257.381 3.449 70 20 CGID Cc1ccc2c(c1)[C@@H](NC1CCN(C(C)C)CC1)CC2 160767889 OIGQGOXBOJHVKT-SFHVURJKSA-N 272.436 3.445 70 20 CGID C[C@@H](NCC(=O)Nc1ccc(Cl)cc1)c1cncs1 161103914 NGMNAIUXNSEOJB-SECBINFHSA-N 295.795 3.086 70 20 CGID CCC(CC)NC(=O)NCc1ccccc1Cl 217304910 VIWDGJLCWPGKOB-UHFFFAOYSA-N 254.761 3.328 70 20 CGID COc1ccc([C@H](C)NC(=O)NCCc2ccccc2)cc1 217304765 SFIIYVVKPKZGBY-AWEZNQCLSA-N 298.386 3.298 70 20 CGID Cc1cc(OCCCS(=O)(=O)Cl)ccc1C(C)C 100495474 JNECKOFHJRKKGI-UHFFFAOYSA-N 290.812 3.456 70 20 CGID CCCC(O)(CCC)CC(=O)Nc1cc([C@H]2C[C@@H]2C)n[nH]1 161034893 JAKSUUZZFMJRAU-RYUDHWBXSA-N 293.411 3.193 70 20 CGID CN(CCC1CCOCC1)c1nc2cc(F)ccc2o1 160544594 LIMPGIFOYVOSBL-UHFFFAOYSA-N 278.327 3.220 70 20 CGID Cc1ccnc(NC(=O)c2cc(F)c(C)cc2F)c1 159874500 OCMYATSPYKDINU-UHFFFAOYSA-N 262.259 3.229 70 20 CGID c1ccc2oc(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)cc2c1 159491353 CXRWXOHYHUXGQJ-OIISXLGYSA-N 283.371 3.480 70 20 CGID CCC[C@H](C(=O)Nc1c[nH]c(=O)c(C)c1)c1ccccc1 159598969 MZBWDTFTOYIGRC-HNNXBMFYSA-N 284.359 3.206 70 20 CGID CCO[C@H]1C[C@@H](NCc2cccc3[nH]ccc23)C1(C)C 217891874 TXMZMXBRQFJCLE-CVEARBPZSA-N 272.392 3.461 70 20 CGID COc1cc(CN[C@@H]2CCC[C@@H](C)[C@@H]2C)cc2c1OCO2 218379471 RHGGXJFATZRDEY-MBNYWOFBSA-N 291.391 3.338 70 20 CGID CC[C@H](C)[C@@H](C(=O)N1CCC(C)(O)CC1)c1ccccc1 161305104 BQCXNROEXQDWES-GOEBONIOSA-N 289.419 3.190 70 20 CGID CCCn1nccc1CN[C@H](C)c1cc(F)ccc1OC 160059805 FLPKVCQDHHRYOG-GFCCVEGCSA-N 291.370 3.292 70 20 CGID CCn1nccc1CNCc1ccccc1OCC(C)C 160105027 CDLSTAAPQPNKCW-UHFFFAOYSA-N 287.407 3.228 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1CSc2ccccc21 160180155 AMBDKGYGLJXFKL-CYBMUJFWSA-N 273.401 3.182 70 20 CGID COc1cc(C)ccc1CNC(=O)N[C@@H](C)CC(C)C 160259659 SZXXOARUYPEXKK-ZDUSSCGKSA-N 278.396 3.237 70 20 CGID C[C@@H](c1ccc(Br)cc1)N(C)C[C@H](O)C1CC1 160871256 ULNLTVWUOWWRDO-HZMBPMFUSA-N 298.224 3.213 70 20 CGID CCCCN1CCC(NC(=O)[C@H](C)c2ccsc2)CC1 159629174 LCHUMCWPYMVVHE-CYBMUJFWSA-N 294.464 3.232 70 20 CGID Cc1ccsc1CCCC(=O)NCC(C)(C)CN(C)C 159909615 IWHIXNOSCOSGGB-UHFFFAOYSA-N 296.480 3.083 70 20 CGID COCCC(C)(C)CNC(=O)Nc1ccnc(C)c1Cl 159957129 KLZUTYVNIOBPLB-UHFFFAOYSA-N 299.802 3.228 70 20 CGID CN(CCC1CCCCC1)C(=O)NCCc1cscn1 159395734 XBYXETJTOMAORZ-UHFFFAOYSA-N 295.452 3.297 70 20 CGID CCc1nc(CN[C@H](CC)c2ccc(Cl)cc2)n[nH]1 160287238 OIPLHVOSCKYNGZ-GFCCVEGCSA-N 278.787 3.261 70 20 CGID CCCCOCCCN[C@H]1CCCc2cccnc21 160236968 DZNKLKOCHKPEBA-HNNXBMFYSA-N 262.397 3.255 70 20 CGID Cc1ccc(C(=O)N2CC=C(C(F)(F)F)CC2)c(F)c1 160580109 NHLRTWGGUCJAOF-UHFFFAOYSA-N 287.256 3.469 70 20 CGID C[C@H](NCC(C)(C)NC(=O)OC(C)(C)C)c1cscn1 218266611 WWISMQYEQSGLAH-JTQLQIEISA-N 299.440 3.097 70 20 CGID CC[C@@H](NCCCOCc1ccc(OC)cc1)C1CC1 161100482 ZQPXDBMLGBGFKJ-QGZVFWFLSA-N 277.408 3.380 70 20 CGID Cc1cccc(C)c1OCCCN[C@H](C)c1cnn(C)c1 161235082 QMWCDUOKXWRNMR-OAHLLOKOSA-N 287.407 3.157 70 20 CGID CCCC1(CNC(=O)Nc2cnc(C3CC3)nc2)CC1 160012427 SFLDNNWSWNZXHW-UHFFFAOYSA-N 274.368 3.056 70 20 CGID COC[C@@H](Cc1ccccc1)N[C@@H](C)c1ccco1 160196944 PSYFVYHHRYWTNH-DZGCQCFKSA-N 259.349 3.188 70 20 CGID O=C(/C=C/c1ccc(Cl)cc1)NCC1(CO)CCCC1 160272820 GAVBYOOCABKJBT-VMPITWQZSA-N 293.794 3.022 70 20 CGID CC(C)c1nsc(N[C@@H]2CCO[C@@H](C3CC3)C2)n1 160373516 SZAWLLVJPHMHGE-GHMZBOCLSA-N 267.398 3.031 70 20 CGID CC(C)c1nsc(N2CCC[C@H]2CN2CCCCC2)n1 160429669 LJHROYXGSCMPOL-ZDUSSCGKSA-N 294.468 3.116 70 20 CGID CCCC1(CNC(=O)c2cccc(-n3ccnc3)c2)CC1 160727309 MUJICZWBVVBFNF-UHFFFAOYSA-N 283.375 3.182 70 20 CGID C[C@H](Cc1ccc(Cl)cc1)N(C)CCn1ccnc1 159836418 QZRULECNEIFAHU-CYBMUJFWSA-N 277.799 3.100 70 20 CGID C[C@@H](c1c(F)cccc1F)N(C)CCOCC1CC1 159647164 KBFCXBMUSLHGOZ-NSHDSACASA-N 269.335 3.384 70 20 CGID CO[C@@H]1CCCC[C@H]1Nc1nc(C(C)(C)C)ns1 159674802 IJIAYVAGJAGLRO-NXEZZACHSA-N 269.414 3.205 70 20 CGID CC(C)CCn1ccc(NC(=O)NCc2cccs2)n1 159509475 TYNRPPSWUCSJLK-UHFFFAOYSA-N 292.408 3.312 70 20 CGID CCS[C@H]1CCC[C@H]1NC(=O)c1ccc(F)c(OC)c1 159703096 YWRGQADRBUCOKF-OCCSQVGLSA-N 297.395 3.238 70 20 CGID Cc1cnc(NC(=O)c2ccc(C(C)C)nc2)s1 159705653 UZNAMAQEDGBFLJ-UHFFFAOYSA-N 261.350 3.222 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@@H](C)c1cccnc1 159748182 IUNXMDXOAFPCRI-YUTCNCBUSA-N 286.400 3.432 70 20 CGID CCC[C@H](C)CC(=O)NCc1nc2cccc(C)c2n1C 159772763 BYPPVNCPUALMPI-LBPRGKRZSA-N 287.407 3.324 70 20 CGID O=C(OCCSc1ccccc1)c1ccc(O)cc1O 216705358 XGDAYXFXZQGQBK-UHFFFAOYSA-N 290.340 3.047 70 20 CGID C[C@@H](NC[C@@H]1CCc2ccccc21)C1CCOCC1 161008568 NVQKNRUSFWQHBB-CJNGLKHVSA-N 259.393 3.121 70 20 CGID c1cc2c(cc1[C@@H](N[C@H]1CCSC1)C1CC1)OCCO2 161123342 JCVOGCJFXKLUSS-BBRMVZONSA-N 291.416 3.004 70 20 CGID O=C(C1CC=CC1)N1CC[C@@H](Oc2ccccc2Cl)C1 161207814 SNGWDRUQLZHHLD-CYBMUJFWSA-N 291.778 3.286 70 20 CGID C[C@H](NCC1(CO)CCCC1)c1ccc(OC(F)F)cc1 160079657 HYEOKBJGORYJGV-LBPRGKRZSA-N 299.361 3.491 70 20 CGID CO[C@@]1(CN[C@@H]2CCC(C)(C)c3ccccc32)CCOC1 160101669 NWOBYKQKTQAEMM-SJLPKXTDSA-N 289.419 3.194 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCCCN(C)Cc1ccccc1 160166085 NBCCMSJCMOHLHE-FUHWJXTLSA-N 288.435 3.061 70 20 CGID CCC(CC)CC(=O)Nc1cc(C2CC2)nc(C)n1 160275901 MONBXDNWFFTUMW-UHFFFAOYSA-N 261.369 3.427 70 20 CGID CCC[C@H](N[C@H]1CCc2nc(C)nn2C1)C1CCCCC1 160462862 WEHULPRFAGJZPS-HOTGVXAUSA-N 290.455 3.240 70 20 CGID COCCCOc1ccccc1NC(=O)[C@@H]1CC1(C)C 160590944 FVVIACNQLLWXJG-LBPRGKRZSA-N 277.364 3.087 70 20 CGID CCCC[C@H](CC)CC(=O)N[C@@H](CO)CC(C)C 160642891 AQCCKRMQHZCLDQ-UONOGXRCSA-N 257.418 3.116 70 20 CGID CC(C)[C@H]1CN(C(=O)C[C@H](C)c2ccncc2)CCS1 160827028 PQRAACXXKVJKEW-DZGCQCFKSA-N 292.448 3.175 70 20 CGID Cc1ccc(C(C)C)c(OCCC(=O)NCC(F)F)c1 159418750 CAHGIQLCGUYJHG-UHFFFAOYSA-N 285.334 3.269 70 20 CGID Cc1ccc([C@H]2CCCCCN2CCn2ccnc2)o1 159844429 BGGZFESWNXZNPX-OAHLLOKOSA-N 273.380 3.402 70 20 CGID Cc1cnc([C@@H](C)NC(=O)N[C@H](C)CC(C)C)s1 159394555 FRIPOHYDSZTSRT-MWLCHTKSSA-N 269.414 3.246 70 20 CGID Cc1ccccc1NC(=O)N(C)[C@H]1CCCc2c1cnn2C 159580161 DMYATXNLGWREST-HNNXBMFYSA-N 298.390 3.270 70 20 CGID COc1cc(NCCOc2ccccc2)ccc1F 160293278 UTZBPSGLGSURTP-UHFFFAOYSA-N 261.296 3.325 70 20 CGID CS[C@@H](C)CNC(=O)[C@@H](C)Cc1cccc(Cl)c1 161375529 SPJMEILRLTZLTF-QWRGUYRKSA-N 285.840 3.386 70 20 CGID Cc1cc(OCCN2CCC(C)(O)CC2)ccc1C(C)C 161229192 XONCGEFNQAWEQD-UHFFFAOYSA-N 291.435 3.344 70 20 CGID C[C@H](NC[C@H](C1CCCCC1)N(C)C)c1cncs1 160400194 DFBNFTWJTUHQSE-GXTWGEPZSA-N 281.469 3.304 70 20 CGID CC[C@H](C)[C@H](C)NCc1ccc(CN2CCOCC2)cc1 160572894 XROTXJYZPHPOHX-HOTGVXAUSA-N 290.451 3.043 70 20 CGID CC[C@@H](C)[C@@H](C)NC(=O)N1CCC(CCCN(C)C)CC1 160931961 KYWHOEMYZXTCMS-HUUCEWRRSA-N 297.487 3.184 70 20 CGID CC[C@H](C)[C@@H](O)CNC(=O)[C@@H](C)Cc1ccccc1Cl 159396512 LONURADEVUUKEF-HUBLWGQQSA-N 297.826 3.042 70 20 CGID CC(C)Sc1ccccc1NC(=O)CNCC1CC1 160347810 MKUSAWMRBSZWGB-UHFFFAOYSA-N 278.421 3.125 70 20 CGID O=c1[nH]c(CCCl)nc2scc(-c3ccccc3)c12 55492287 LSMYFCPMAXQRQB-UHFFFAOYSA-N 290.775 3.433 70 20 CGID C[C@H]1CC=CC[C@@H]1COC(=O)c1ccc2c(c1)CCC(=O)N2 216788801 BKFDKSGKPIRPEP-SWLSCSKDSA-N 299.370 3.330 70 20 CGID Cc1cccc(CCNC(=O)N2CCc3ccccc3C2)c1 217406982 OZWUJJXNOSUGHQ-UHFFFAOYSA-N 294.398 3.305 70 20 CGID CCCn1c(CNCCCCCOC)nc2ccccc21 218240965 FQOSJMFPSFLDRJ-UHFFFAOYSA-N 289.423 3.353 70 20 CGID CCn1nc(C)c(CN(C)Cc2cccc(F)c2)c1C 160462258 PRUVPFPZESOUSH-UHFFFAOYSA-N 275.371 3.291 70 20 CGID C[C@H](N[C@H]1CCC[C@@H](C)[C@@H]1C)C(=O)OC(C)(C)C 217767417 LTNWJFLBBZHRBI-VOAKCMCISA-N 255.402 3.131 70 20 CGID CCC(CC)(CN)C(=O)Nc1nc2c(C)cccc2s1 161166047 IBAMDAJMSQQMLA-UHFFFAOYSA-N 291.420 3.308 70 20 CGID Cc1nccc(NC(=O)N(C)C2CCC2)c1Cl 160005998 BVVQNGFDFTXCJA-UHFFFAOYSA-N 253.733 3.060 70 20 CGID Cc1cc(N[C@@H]2CCO[C@@H](C3CC3)C2)nc(C(C)C)n1 160375658 VUYDZKHVYJHSLU-ZIAGYGMSSA-N 275.396 3.278 70 20 CGID CCOCCC1(CNC(=O)C[C@H]2C=CCC2)CCC1 160521257 UPYDPSCTLOZJKZ-AWEZNQCLSA-N 265.397 3.056 70 20 CGID O=C(c1cc(F)cc(Cl)c1O)N1CCC2(CCC2)C1 160524561 SYAKIDDLHBXLDP-UHFFFAOYSA-N 283.730 3.201 70 20 CGID CS[C@@H](C)CC(=O)N[C@@H](C)Cc1ccccc1F 160849295 PPAFXEWMZAUKBA-QWRGUYRKSA-N 269.385 3.015 70 20 CGID CC[C@@H](NCCCCC(=O)OC)c1ccc(F)cc1F 160832549 MZMACCDUPWDGFU-CQSZACIVSA-N 285.334 3.349 70 20 CGID Cc1ccccc1[C@@H](C)NCCCOC[C@H]1CCOC1 159668986 JNZRPXWCOAVQNW-HZPDHXFCSA-N 277.408 3.089 70 20 CGID Cc1cc(C)cc(CCC(=O)NCc2ccc(O)cc2)c1 159714850 LQYWAHBDYMVHRZ-UHFFFAOYSA-N 283.371 3.258 70 20 CGID CCCOCc1ccccc1CNC(=O)NC1(C)CCC1 159391090 UHZKGLPEAZUEAQ-UHFFFAOYSA-N 290.407 3.355 70 20 CGID COc1cc(N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)ccc1F 159975427 DMGCHMZMVFHZTO-GLQYFDAESA-N 279.355 3.450 70 20 CGID COc1ccc(NC(=O)c2csc(C(C)C)n2)cc1N 161237006 CLGNETAIRYFOBK-UHFFFAOYSA-N 291.376 3.110 70 20 CGID CCC[C@H](C(=O)N(CC(=O)OC)C1CCCC1)C(C)C 161029679 HCJIMCVWVFSFCB-AWEZNQCLSA-N 283.412 3.003 70 20 CGID CC[C@@H](CO[C@@H](C)CC(C)C)CS(=O)(=O)Cl 114472718 NNUGQIQICIJMON-QWRGUYRKSA-N 270.822 3.032 70 20 CGID CCOC[C@@H]1CCN(C(=O)CC2CCC(C)(C)CC2)C1 160400068 VBMFBVXTHFAOJF-OAHLLOKOSA-N 281.440 3.478 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)[C@@H](C)CSC 161130332 UQHXPOBKNBPZKA-YNEHKIRRSA-N 257.443 3.413 70 20 CGID C[C@@H]1CN(C)[C@H](C)C[C@@H]1NCC1(c2ccc(F)cc2)CC1 161359441 UXPCPICRXBWRLF-CPUCHLNUSA-N 290.426 3.176 70 20 CGID CCOCC(=O)N1CCCC[C@@H]1CCCc1ccccc1 161364045 NMACQPDXVHXWIF-QGZVFWFLSA-N 289.419 3.427 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@@H]1CSCCS1 160421456 FXYNAXQOLLSZKQ-JQWIXIFHSA-N 299.486 3.090 70 20 CGID CC(C)c1ccc(C(=O)N2CCc3sccc3C2)cn1 160531501 FDYMHNXHSGZXBA-UHFFFAOYSA-N 286.400 3.465 70 20 CGID C[C@@H](C(=O)NCCc1ccco1)c1c(F)cccc1F 160558811 SDLVRFPSFVGGGB-SNVBAGLBSA-N 279.286 3.020 70 20 CGID CC[C@@H](NC(=O)CC[C@@H]1CCCCO1)c1c(C)noc1C 160712411 XKRSOJYKSQFDCA-UONOGXRCSA-N 294.395 3.208 70 20 CGID CC[C@@H](C)[C@@](C)(O)CNc1nc(C(C)(C)C)ns1 159448805 FWRHLKUFFAPXJN-RNCFNFMXSA-N 271.430 3.045 70 20 CGID CNC(=O)c1cccc(NCc2coc3ccccc23)c1 159796032 KPAYRBHEGCIYDO-UHFFFAOYSA-N 280.327 3.405 70 20 CGID Cc1ccsc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 159580651 XTAPOQGAOIEESW-YUTCNCBUSA-N 263.406 3.104 70 20 CGID CC[C@@H](NCc1cnn(C)c1C)c1ccc(F)cc1 161308019 DRIGCPZXFOUJCC-OAHLLOKOSA-N 261.344 3.109 70 20 CGID Cc1cc(C(=O)NCCc2c(C)cccc2C)ccc1N 217482659 LBHQIRMPWCFORL-UHFFFAOYSA-N 282.387 3.167 70 20 CGID O=C(CCl)N[C@@H](Cc1ccccc1)c1cccs1 144282551 RAYABPVMNSKBCT-LBPRGKRZSA-N 279.792 3.387 70 20 CGID CCC/C(C)=C\C(=O)Nc1cccc(S(=O)(=O)F)c1 809282755 ZCKQLMSTZWOZQU-NTMALXAHSA-N 285.340 3.030 70 20 CGID CCOCCC1(CNC(=O)N2C[C@H](C)CCC[C@H]2C)CC1 161509181 ZROSPHIUZXLLFH-HUUCEWRRSA-N 296.455 3.413 70 20 CGID Cc1ccc(-c2nnc(NC(=O)[C@H]3CCC[C@H](C)C3)[nH]2)o1 160259008 IIVOVBDLPULBPL-ONGXEEELSA-N 288.351 3.138 70 20 CGID CCCC1(CNC(=O)c2ccc(Cn3ccnc3)cc2)CC1 160622598 MANFQILHDFDXHU-UHFFFAOYSA-N 297.402 3.242 70 20 CGID COc1cccc(Cl)c1CC(=O)N1C[C@H]2CCC[C@H]2C1 160626413 HSCVWMWNPDYOQM-TXEJJXNPSA-N 293.794 3.150 70 20 CGID O=[S@@](Cc1nccs1)c1ccc(Cl)cc1 160627118 IKUIXLSDDFBUBB-OAHLLOKOSA-N 257.767 3.104 70 20 CGID CCC(CC)n1ncc(C(=O)N2C[C@H]3CC[C@@H]2C3)c1C 160721580 SGBXIUMEGCZZDI-GXTWGEPZSA-N 275.396 3.177 70 20 CGID Cc1nnc([C@H](C)N[C@@H](C)c2cccc(F)c2F)o1 159404882 BAKURZYXSLMGJA-YUMQZZPRSA-N 267.279 3.068 70 20 CGID COC(=O)[C@@H](C)CN(C(=O)C1CCC(C)(C)CC1)C1CC1 159834861 FUGDBDJITZYAPO-LBPRGKRZSA-N 295.423 3.003 70 20 CGID Cc1nccc(NC(=O)N2CC[C@@H](C)[C@@H]2C)c1Cl 159647654 JWBPCPWZSRNYPK-SCZZXKLOSA-N 267.760 3.306 70 20 CGID CCCC[C@@H](CCC)NC(=O)N(C)CC1CCOCC1 159654204 BORXZFFFFZGDTQ-OAHLLOKOSA-N 284.444 3.413 70 20 CGID CCCCCC(=O)N[C@H]1CCOC2(CCCC2)C1 159535031 YMTXBTUWWNPWBN-ZDUSSCGKSA-N 253.386 3.175 70 20 CGID C[C@@H](NC(=O)Nc1ccc(F)c(F)c1)C1CCC1 159386170 HONSACHHQZJXFZ-MRVPVSSYSA-N 254.280 3.275 70 20 CGID CO[C@@]1(CNc2ccc3ccccc3c2)CCOC1 160641977 VNALQVCWTPBZLD-MRXNPFEDSA-N 257.333 3.057 70 20 CGID O=S(=O)(Cl)C[C@@H](F)c1csc2ccccc12 1537959021 UKVAOPRSTAOADK-SECBINFHSA-N 278.757 3.481 70 20 CGID Cc1ccc2sc(S(=O)(=O)Cl)c(C)c2c1 100444100 KYKSZOHCIBGWPY-UHFFFAOYSA-N 260.767 3.446 70 20 CGID COC[C@H](N[C@@H]1CCOc2c(Cl)cccc21)C1CC1 161293047 YIKFNCQHBLIJKL-KGLIPLIRSA-N 281.783 3.178 70 20 CGID CCc1ccc([C@@H](C)C(=O)N(C)Cc2cccn2C)cc1 160484218 QXDMMFWVXMKYCR-CQSZACIVSA-N 284.403 3.350 70 20 CGID CC1(C)C[C@@H](NC(=O)Nc2cc(F)ccc2F)CCO1 160793549 YSDOVKJDAVOTNT-JTQLQIEISA-N 284.306 3.044 70 20 CGID CCc1noc(C)c1CSC[C@@H]1CCCCO1 159676160 GOVIWSSBCOEDEJ-NSHDSACASA-N 255.383 3.348 70 20 CGID O=C(NCCc1cscn1)Nc1cccc(Cl)c1F 159559135 RUGLSAGGGKAVQS-UHFFFAOYSA-N 299.758 3.300 70 20 CGID COCCC1(C(=O)Nc2ccc(N(C)C)c(Cl)c2)CC1 159390682 HPUINLGGJRYMFR-UHFFFAOYSA-N 296.798 3.161 70 20 CGID CC[C@H](c1ccc(F)cc1)N1CCC[C@@H](CNC)C1 218071584 HWKGKIDXXLGJQM-XJKSGUPXSA-N 264.388 3.208 70 20 CGID Cc1ccccc1[C@H](C)N[C@H]1CCN2CCCC[C@@H]12 217675296 SRZUNUYAHIYJPN-XIRDDKMYSA-N 258.409 3.272 70 20 CGID CC(C)[C@@H](CCO)NC(=O)c1csc2c1CC[C@@H](C)C2 161288772 RUSVINJIXFXANG-BXUZGUMPSA-N 295.448 3.010 70 20 CGID COc1ccc([C@@H](C)NC(=O)NCCc2ccccc2)cc1 217304764 SFIIYVVKPKZGBY-CQSZACIVSA-N 298.386 3.298 70 20 CGID CO[C@@H]1CCCC[C@@H]1N[C@@H](C)c1cccc(NC(C)=O)c1 217951524 HQMQUNBVDHUSKB-AFAVFJNCSA-N 290.407 3.253 70 20 CGID CC(=O)c1ccc(NC(=O)N2CC=C(C)CC2)cc1 159968504 UVURTSKIOZSUAU-UHFFFAOYSA-N 258.321 3.073 70 20 CGID CS[C@H](C)CNc1cc(Cl)nc(C2CC2)n1 161056783 OVQHXBLPAPITLV-SSDOTTSWSA-N 257.790 3.171 70 20 CGID O=S(=O)(Cl)c1c(Cl)cc(Cl)c(O)c1Cl 78098968 FSFBKEVABNPVGC-UHFFFAOYSA-N 295.958 3.280 70 20 CGID CN(C(=O)[C@]1(C)CCNC1)c1ccc(-c2ccccc2)cc1 161082307 JPEXADFGXFKQRM-LJQANCHMSA-N 294.398 3.316 70 20 CGID CC[C@H](SC)c1nc(-c2ccc(C(=O)OC)cc2)no1 161333385 XZNJPAGFXBHUGY-NSHDSACASA-N 292.360 3.337 70 20 CGID CN(C(=O)c1ccc2cc[nH]c2c1)c1ccc2c(c1)OCO2 160252848 KXYPRPNPIHEVOM-UHFFFAOYSA-N 294.310 3.173 70 20 CGID CC[C@H](NC(=O)c1c(F)cccc1F)c1c(C)noc1C 160332185 QMPWMBIXDAMGGM-LBPRGKRZSA-N 294.301 3.451 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2CCO[C@@H](C3CC3)C2)n1 160356382 INMAMQOQZYLADK-GHMZBOCLSA-N 281.425 3.205 70 20 CGID Cc1cc(C(=O)N(C)c2ccc3c(c2)OCO3)sc1C 160383532 GBUDPNLLBXVVRQ-UHFFFAOYSA-N 289.356 3.370 70 20 CGID CCOCc1cccc(NC(=O)c2ccnn2C(C)C)c1 160559720 GPJFNKSHFZFFJZ-UHFFFAOYSA-N 287.363 3.253 70 20 CGID CC(C)CCNC(=O)Nc1ccn(CCC(C)C)n1 160669683 VDUUOTUYFXDQNL-UHFFFAOYSA-N 266.389 3.097 70 20 CGID CC[C@H](C)[C@@H](C(=O)N[C@@H](CCO)C(C)C)c1ccccc1 160773188 RTHNXJKPEGGATK-BHYGNILZSA-N 291.435 3.340 70 20 CGID Cc1cc2cc(NC(=O)[C@@H]3CCC(=O)C[C@H]3C)ccc2[nH]1 159852031 OYAKVFKAPNIEBS-MEBBXXQBSA-N 284.359 3.420 70 20 CGID CC[C@@H](C(=O)NC[C@@H](C)SC)c1ccc(F)cc1 161336283 MXFWRTXUIAKCGO-ZWNOBZJWSA-N 269.385 3.187 70 20 CGID C[C@H](Cc1ccccc1F)C(=O)NCc1cccc(O)c1 160226570 KLEITMRVYOJTLC-GFCCVEGCSA-N 287.334 3.026 70 20 CGID Cc1ncc([C@H](C)NCCCN2CCCC[C@@H]2C)c(C)n1 160264947 ANSBVCSTRQCFPI-KBPBESRZSA-N 290.455 3.009 70 20 CGID CSCC[C@@H](C)N(C)C(=O)C[C@@H](C)c1ccncc1 160711494 GJWCAHWORXDEPI-CHWSQXEVSA-N 280.437 3.175 70 20 CGID CC[C@@H](NC(=O)CC[C@H]1CCCCO1)c1c(C)noc1C 160712644 XKRSOJYKSQFDCA-ZIAGYGMSSA-N 294.395 3.208 70 20 CGID Cc1cccc([C@H](C)C(=O)N[C@@H](C)CN2CCCCC2)c1 159754782 ZTKPQZHOAUBXHY-HOTGVXAUSA-N 288.435 3.089 70 20 CGID C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCCOCC(F)(F)F 159376727 DXPCVFWZIMOAOI-NOZJJQNGSA-N 291.288 3.228 70 20 CGID COc1ccc(C(=O)N(C)Cc2ccoc2C)c(F)c1 218006075 WNWFECISLYIWRV-UHFFFAOYSA-N 277.295 3.008 70 20 CGID CC(C)Oc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1 218117126 QVMRBZNTWHHGBZ-ROUUACIJSA-N 288.435 3.190 70 20 CGID O=C(/C=C\c1ccccc1)N(CCCO)Cc1ccccc1 218748466 TZKIMSGMRPDGDC-SEYXRHQNSA-N 295.382 3.111 70 20 CGID CC1(NC(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)CCC1 161360706 VSGATXSEWCHORE-OLZOCXBDSA-N 282.428 3.070 70 20 CGID COc1cc(N[C@@H](C)c2cncs2)ccc1F 160145964 GQLUQSDNAIJTBQ-QMMMGPOBSA-N 252.314 3.464 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cccc(Nc2cnn(C)c2)c1 160407808 CFCUHEHLSLBKQN-STQMWFEESA-N 298.390 3.177 70 20 CGID CC(C)(C)c1nnc(N[C@H]2CCO[C@H](C3CC3)C2)s1 160472864 NHNPGHWJQWFJBF-QWRGUYRKSA-N 281.425 3.205 70 20 CGID Fc1ccc(SCCn2ccnc2)cc1Cl 159728413 PCBRDIGOSWAIGW-UHFFFAOYSA-N 256.733 3.468 70 20 CGID C[C@@H]1Cc2ccccc2[C@@H]1NC[C@](C)(O)c1ccsc1 159964370 KVCBYWHSTXVBCQ-JLZZUVOBSA-N 287.428 3.479 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1cccc(F)c1 217696461 AUDJPNAJVXHOJZ-MAZHCROVSA-N 262.372 3.103 70 20 CGID C[C@H](CNCc1cc(F)cc(Cl)c1)N1CCCCC1 160906103 QUQAMYJOOLOJQA-GFCCVEGCSA-N 284.806 3.443 70 20 CGID C[C@H]1CC[C@@H](CC(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237751 IVJQULABODPCMT-WDEREUQCSA-N 299.367 3.110 70 20 CGID CS[C@H](C)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 161338749 GWOKMUVICQSLNY-GHMZBOCLSA-N 299.823 3.071 70 20 CGID CC(C)CC[C@H](C)NC[C@](C)(O)c1ccsc1 160044346 VZNINDIATOILJZ-JSGCOSHPSA-N 255.427 3.370 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCCO1)c1cc2ccccc2o1 160194284 KTFOCGFDXHGFCQ-RISCZKNCSA-N 273.332 3.179 70 20 CGID CSC[C@H](CCO)N[C@@H](C)c1cc2c(s1)CCCC2 160240468 WIHWFTPNBXUXLD-AAEUAGOBSA-N 299.505 3.392 70 20 CGID CCc1ccc([C@H](CC)N[C@@H]2CCc3nc(C)nn3C2)cc1 160426442 NEKDMNKCAZWQDU-SJORKVTESA-N 298.434 3.205 70 20 CGID CCN1CC[C@@H](NCCCCc2nc(C)cs2)[C@H](C)C1 160659378 DAKBPLZLBWTDPV-UKRRQHHQSA-N 295.496 3.094 70 20 CGID C[C@H](OC1CCCCCC1)C(=O)Nc1ccccc1O 160954095 NGMXOZCODQJTSV-LBPRGKRZSA-N 277.364 3.459 70 20 CGID CCN1CC[C@@H](NCCc2cc(C)cc(C)c2)[C@H](C)C1 159466487 RQPZYGVAYVMFEQ-SJLPKXTDSA-N 274.452 3.166 70 20 CGID CCN(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H]1CC=CCC1 159882077 OTRXPVZYJFESFD-CQSZACIVSA-N 297.402 3.101 70 20 CGID CCC(CC)CS(=O)(=O)N(C)[C@@H](CC)c1ccncc1 159714193 SNKZRNLAPCCFSF-HNNXBMFYSA-N 298.452 3.231 70 20 CGID CC[C@H](NC(=O)C[C@H]1C=CCC1)c1c(C)noc1C 159947967 XDLNODNHPANNGR-STQMWFEESA-N 262.353 3.215 70 20 CGID CCC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(C)cc2)CCO1 159952113 UYGMAGIXODDUMS-GDBMZVCRSA-N 290.407 3.267 70 20 CGID CCCN1CCC(NCc2cccc3cc[nH]c23)CC1 218079035 ZWEUAEKYVRYKGX-UHFFFAOYSA-N 271.408 3.132 70 20 CGID C[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1)C1CCC1 159979535 CVKLSGNXSWWRNG-SECBINFHSA-N 289.347 3.283 70 20 CGID COc1ccc([C@H](C)NCC2(CO)CCCC2)cc1F 160120207 FYALEOVYTAAYOR-LBPRGKRZSA-N 281.371 3.038 70 20 CGID Cc1ccccc1C1CC(N[C@H]2CCN3CCCC[C@@H]23)C1 217693485 OCXXZHFVXSMTEP-VHZYLWGESA-N 284.447 3.457 70 20 CGID Nc1ccc2c(N[C@@H]3CCCc4sccc43)ncnc2n1 161062276 BTLZYWWKTCXLLZ-LLVKDONJSA-N 297.387 3.158 70 20 CGID CC[C@H](C)NC(=O)c1cccc(CN[C@H](CC)C2CC2)c1 161136664 VILGSRIAANAANN-SUMWQHHRSA-N 288.435 3.493 70 20 CGID Cc1c(C(=O)Nc2ccc(F)cc2F)cnn1CC(C)C 160029330 YFXHQSFNMOGGAF-UHFFFAOYSA-N 293.317 3.378 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCCSc1ccccc1 160121815 IDXNNSYOLQWVLS-HIFRSBDPSA-N 263.406 3.331 70 20 CGID C[C@@H](Cc1ccccc1)C(=O)N(C)c1ccc2c(c1)OCO2 160184472 HVVXGZCMKFLHOB-ZDUSSCGKSA-N 297.354 3.257 70 20 CGID CC[C@@H](c1ccccc1)S(=O)(=O)[C@H](C)c1nnc(C)o1 160433240 IMHSIKXCIIEOQC-MFKMUULPSA-N 294.376 3.005 70 20 CGID CN(C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1)C1CC1 160508963 XXECSZJAVFUUHD-GOEBONIOSA-N 272.392 3.202 70 20 CGID CCS[C@H]1CCCCN(C(=O)CCCn2cccc2)C1 159503603 QSSUZCFEYVPOOD-HNNXBMFYSA-N 294.464 3.403 70 20 CGID CCOCCCN(C)[C@@H](C)c1cc(F)ccc1F 159366125 IIACLUWEBSKXDM-NSHDSACASA-N 257.324 3.384 70 20 CGID C[C@H]1CCC[C@@H](C(=O)N(Cc2cccnc2)C2CC2)C1 159772183 QQMGSYGGXNEILU-DZGCQCFKSA-N 272.392 3.399 70 20 CGID C[C@H](CNCc1coc2ccccc12)CN1CCCC1 159823367 JWVZLBAANINMLJ-CQSZACIVSA-N 272.392 3.254 70 20 CGID CCSCCN1CCC[C@H]1c1cccc(C)n1 159702282 QUMWNHQBQRZZNX-AWEZNQCLSA-N 250.411 3.280 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCCC[C@@H]2C)n1 161006412 QVUMKQYFHIFQOP-ZDUSSCGKSA-N 278.400 3.336 70 20 CGID Cc1nccc(NC(=O)NC[C@@H]2CCCS2)c1Cl 160021939 QINOKMINBAYSRI-VIFPVBQESA-N 285.800 3.061 70 20 CGID C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@H](C)C1 160308981 JPXOASKBTWTTMU-XOUADPBQSA-N 294.439 3.022 70 20 CGID CCCC1(CNC(=O)[C@H](C)Sc2ccccn2)CC1 160752190 PFTSWICJQULYND-LBPRGKRZSA-N 278.421 3.259 70 20 CGID CCOC[C@@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160933081 KXQPLNLDAOCOPS-CYBMUJFWSA-N 267.413 3.088 70 20 CGID CCC[C@@H](C)C(=O)N[C@@H]1CCOC2(CCCC2)C1 159537616 XQMLKWAZWCSFCE-CHWSQXEVSA-N 253.386 3.031 70 20 CGID C[C@](O)(CN[C@@H]1CCc2ccccc21)c1ccsc1 159932294 GTBVZLJXFDFIKW-CVEARBPZSA-N 273.401 3.233 70 20 CGID C[C@H]1CCCCN1C[C@@H](O)c1cc2ccccc2o1 216875911 SFTOUFHEBXJTMI-GXTWGEPZSA-N 259.349 3.341 70 20 CGID Fc1c(Cl)cccc1NCc1nnc2n1CCCC2 217317843 PPTBGYMRJJWEPM-UHFFFAOYSA-N 280.734 3.019 70 20 CGID CN(Cc1cccc2ccccc12)[C@@H](CN)C1CC1 159680209 RISGSKYVYIAIET-KRWDZBQOSA-N 254.377 3.009 70 20 CGID CC(C)N(CCSCc1ccc(C(N)=O)cc1)C(C)C 161017593 IYWKHJSRPSXTRH-UHFFFAOYSA-N 294.464 3.138 70 20 CGID CCc1nnsc1C(=O)N(C)[C@@H]1CCCC[C@H]1CC 161041031 WQNBSKFGXXPAHT-ZYHUDNBSSA-N 281.425 3.141 70 20 CGID CCN(C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)[C@H](C)C(C)C 161120860 CSQGHYTZBMJUNM-BARDWOONSA-N 294.439 3.020 70 20 CGID CC[C@H](S[C@H](CC)c1ccc(F)cc1F)C(N)=O 161363414 LLTQUXLLAQCAMQ-NEPJUHHUSA-N 273.348 3.413 70 20 CGID CC[C@H](C)NCCC1CCN(CC(F)(F)F)CC1 160013425 RDJUMYAXCAYAKB-NSHDSACASA-N 266.351 3.039 70 20 CGID C[C@@H](CC(=O)N1c2ccccc2OC[C@H]1C)c1ccncc1 160906616 PQZUWYSJIFRWFS-UONOGXRCSA-N 296.370 3.389 70 20 CGID Cc1cc(NC(=O)C[C@H]2C[C@H](C)CC(C)(C)C2)c[nH]c1=O 159650313 GLHXAOZVCGKUCT-WCQYABFASA-N 290.407 3.474 70 20 CGID CC(C)(C)Cc1cc(NC(=O)c2cccc3[nH]cnc23)[nH]n1 159684485 OWSRBOONGIXNQM-UHFFFAOYSA-N 297.362 3.127 70 20 CGID O=C(Oc1cccc(Cl)c1Cl)[C@H]1CCCCO1 159557312 BCZSRGNRTWSYPR-SNVBAGLBSA-N 275.131 3.468 70 20 CGID CCC(CC)[C@H](O)CNC(=O)c1cc(C)cc(Cl)c1 218064253 PDFMXOSIWURHLF-CQSZACIVSA-N 283.799 3.175 70 20 CGID CC(C)[C@@H](CNCc1cccc2cc[nH]c12)N1CCCC1 218100486 IMEVKEJHDOLXCB-QGZVFWFLSA-N 285.435 3.378 70 20 CGID CCCCCCN[C@@H](CN1CCOCC1)c1ccccc1 216771260 GUPDXDICMJMDCH-SFHVURJKSA-N 290.451 3.230 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)NCC1(CCOC)CC1 161109692 XUEFPDQVWSJFAG-LSDHHAIUSA-N 296.455 3.413 70 20 CGID COCCC1(CNC(=O)N(C2CC2)[C@H](C)C(C)C)CC1 161112054 MADAEKYKLUVEBH-CYBMUJFWSA-N 282.428 3.022 70 20 CGID O=C(Nc1ccccn1)N[C@@H]1CCCc2sccc21 161168469 GPROPSZDDBJNOF-LLVKDONJSA-N 273.361 3.342 70 20 CGID CC(C)C1CCN(C(=O)[C@H]2CCCCCC[C@@H]2N)CC1 161269452 QRWVKLUXSQTXCL-HOTGVXAUSA-N 280.456 3.179 70 20 CGID CC[C@H](S[C@H](C)C(=O)N(C)C)c1ccc(F)cc1 161355524 WUWAAHYNALNLRY-MFKMUULPSA-N 269.385 3.487 70 20 CGID O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccnc1Cl 160009155 ABOYQVABKSOQRO-KFWWJZLASA-N 298.773 3.051 70 20 CGID C[C@H]1CC[C@@H](C)N1CC1CCN(C(=O)C(C)(C)C)CC1 160148601 NXHTZBLPDVDNOP-OKILXGFUSA-N 280.456 3.144 70 20 CGID Cc1cncc(C(=O)N[C@H]2CCCc3sccc32)c1 160196195 ZVDODGJOEIAYDZ-ZDUSSCGKSA-N 272.373 3.259 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2CCO[C@H](C3CC3)C2)n1 160356117 INMAMQOQZYLADK-MNOVXSKESA-N 281.425 3.205 70 20 CGID CC1CCN(c2ccc(CN[C@@H](C)C(C)C)cn2)CC1 160476472 FEPHKTFGBJHRMT-HNNXBMFYSA-N 275.440 3.452 70 20 CGID CC1(C)C[C@H]1C(=O)N1CCn2cccc2[C@H]1c1ccccc1 160476966 ADZQKVVLNWDYKT-DOTOQJQBSA-N 294.398 3.466 70 20 CGID Cc1ccc(C)c(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1 160915652 HSFLJYTWQGICTA-HOCLYGCPSA-N 288.391 3.383 70 20 CGID CC(C)CCC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 159813609 SSOKRJDISVIERM-GDBMZVCRSA-N 277.408 3.094 70 20 CGID C[C@@H](CC1CCOCC1)NC1CC(C)(C)NC(C)(C)C1 159640052 FKZCNYKPYUSJIJ-ZDUSSCGKSA-N 282.472 3.090 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@H]1CCC[C@H]2OCC[C@H]12 159772518 PEJQPCWNULNQJX-QLFBSQMISA-N 293.794 3.336 70 20 CGID CCc1oc2ccccc2c1CNC[C@](C)(O)CSC 217861880 AVPBZCVNHSSXMX-INIZCTEOSA-N 293.432 3.199 70 20 CGID CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC[C@@H]1CCCN(C)C1 217570986 QNMAUCALANQMAP-TWMKSMIVSA-N 266.473 3.379 70 20 CGID C[C@H](Cc1ccccc1Cl)C(=O)NC1(C)CCOCC1 161403303 UJVOSPBTGZCDMC-GFCCVEGCSA-N 295.810 3.204 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)c2ccsc2)o1 161484363 WDAXTOUVMCDKMN-CYBMUJFWSA-N 291.372 3.465 70 20 CGID CCCCc1noc(COc2ccc3[nH]ccc3c2)n1 160054117 PNOKRWVVEDJIBD-UHFFFAOYSA-N 271.320 3.473 70 20 CGID CSc1ccc(C(=O)NCCc2cccc(O)c2)cc1 160152850 UATYFUXJCMZRDO-UHFFFAOYSA-N 287.384 3.087 70 20 CGID CCC[C@@H](Sc1nncc2ccccc12)C(=O)OCC 160225117 ZYJPIMUHBCAZNN-CYBMUJFWSA-N 290.388 3.454 70 20 CGID CCC[C@@H](C(=O)N[C@H](C)CC(=O)OCC)c1ccccc1 160239699 HWSPMOAGIIIGNL-UKRRQHHQSA-N 291.391 3.028 70 20 CGID CC(C)C[C@@H]1CCCCN1C[C@H](O)COCc1ccco1 160325355 JXQUQPAQSMXVFB-HOTGVXAUSA-N 295.423 3.058 70 20 CGID Cc1nc(Cl)ccc1C(=O)Nc1nnc(C(C)C)s1 160363488 HSHAPRVLHLVKRE-UHFFFAOYSA-N 296.783 3.271 70 20 CGID Cc1ccc(C)c(NC(=O)NCCCC(=O)OC(C)C)c1 160916938 CXYSLJLQYFYEPP-UHFFFAOYSA-N 292.379 3.157 70 20 CGID CCc1ccc([C@H](C)NCc2cn3ccccc3n2)o1 159442150 BBXSKLQFICBPBC-LBPRGKRZSA-N 269.348 3.341 70 20 CGID Cc1ccccc1[C@H](C)NCCCOC[C@H]1CCOC1 159669148 JNZRPXWCOAVQNW-JKSUJKDBSA-N 277.408 3.089 70 20 CGID CC[C@H](NC(=O)C[C@@H]1C=CCC1)c1c(C)noc1C 159948195 XDLNODNHPANNGR-OLZOCXBDSA-N 262.353 3.215 70 20 CGID C[C@@H]1CCCC[C@H]1CNC(=O)C[C@@H](N)c1ccccc1 218460515 GDZOCIUQGYHYGB-VNQPRFMTSA-N 274.408 3.019 70 20 CGID Cc1cscc1C(=O)N[C@@H]1CCCc2cc(N)ccc21 159371314 DKXKZPOVTAABNB-OAHLLOKOSA-N 286.400 3.446 70 20 CGID C[C@H]1CN(Cc2cccc3ccccc23)CC[C@@H]1O 159470094 TUHUCALVAAKYBR-GUYCJALGSA-N 255.361 3.043 70 20 CGID CC[C@@H]1CN(CCC(=O)c2ccc(C)cc2)C[C@H](C)O1 159616565 YEOCRTAJVNQKJP-GOEBONIOSA-N 275.392 3.067 70 20 CGID Cc1nccn1CCCN1CC[C@H](c2ccccc2)C1 159783068 BSMVIEBNYCTMIF-KRWDZBQOSA-N 269.392 3.071 70 20 CGID CN(Cc1ccccc1)CC(C)(C)NCc1ccco1 159367593 BNOOWAQHIVRJET-UHFFFAOYSA-N 272.392 3.280 70 20 CGID Cc1ccc(CN(C)CCOc2ccccc2C)nc1 160489230 CBFIRVHVUPBLDQ-UHFFFAOYSA-N 270.376 3.209 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CC[C@@H]1CCOC1 161001191 IEEFMSHILOPLTK-RBSFLKMASA-N 267.413 3.230 70 20 CGID CCC[C@H](C(=O)NC[C@H](c1ccco1)N(C)C)C(C)C 161053628 SSPNIMNGDIQESP-UONOGXRCSA-N 280.412 3.071 70 20 CGID COC(CN1CCCC[C@H]1c1ccc(C)cc1)OC 161234498 YGPWPIVKVVBLCB-HNNXBMFYSA-N 263.381 3.141 70 20 CGID C[C@@H]1CN(C(=O)c2ccc(CN)o2)CC[C@H]1c1ccccc1 161234927 BRVHSNXLLHAUJA-CZUORRHYSA-N 298.386 3.004 70 20 CGID CCOCCCN1CC[C@H](N[C@@H](C)c2ccco2)[C@H](C)C1 160172564 WVXVXZNAYDPYFB-PMPSAXMXSA-N 294.439 3.067 70 20 CGID CCC(C)(C)C(=O)Nc1ccc(C(=O)NC)cc1Cl 160210619 UKYQLVNKMHGVRD-UHFFFAOYSA-N 282.771 3.074 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)NC[C@@H](C)c1c(C)noc1C 160231825 HKLGIRBYPDSSTJ-DDTOSNHZSA-N 293.411 3.273 70 20 CGID Cc1nc2ccccc2nc1N[C@H]1CCO[C@@H](C2CC2)C1 160405140 WKUWZLIWKORIDV-XJKSGUPXSA-N 283.375 3.308 70 20 CGID C[C@H]1CCCN1C(=O)NCC1(Cc2ccccc2)CC1 160833748 VICBYSRITOOJKB-AWEZNQCLSA-N 272.392 3.203 70 20 CGID CCCN(CC1CC1)C(=O)Nc1cc(C(=O)OC)cs1 160851842 KPOZZNAWYWKDOE-UHFFFAOYSA-N 296.392 3.189 70 20 CGID CC[C@@H](N[C@H](C)C(=O)OC(C)(C)C)c1nc(C)cs1 160889869 GVHCQDKHZXFSNX-GHMZBOCLSA-N 284.425 3.222 70 20 CGID C[C@@H]1CC[C@@H](C(=O)Nc2cc(CC3CCCCC3)n[nH]2)O1 159648440 NCVPIJKNWIIZMF-RISCZKNCSA-N 291.395 3.039 70 20 CGID CC(C)C[C@@H]1COCCN1c1nc(C(C)(C)C)ns1 159846160 CGVBEYMWOZNBOL-LLVKDONJSA-N 283.441 3.087 70 20 CGID CCN(CC)C(=O)C[C@@H](C)NCCc1cc(C)cc(C)c1 159503646 GAVWSIFNDHVNJQ-MRXNPFEDSA-N 290.451 3.083 70 20 CGID C[C@H](NC(=O)Nc1cc(F)ccc1F)C1CCC1 159366451 OYJRXJNEMKNBHE-QMMMGPOBSA-N 254.280 3.275 70 20 CGID CCc1noc(C)c1CSCC(=O)Nc1ccccc1 159982431 HBHATWYPTAELDP-UHFFFAOYSA-N 290.388 3.417 70 20 CGID CCCn1nccc1CN[C@H](C)c1cccc(OC)c1 160095033 LLCHPDQNZCLMBH-CYBMUJFWSA-N 273.380 3.153 70 20 CGID Cn1ncc2c1CCC[C@H]2NCc1cc(F)cc(Cl)c1 160869474 FTWZWVQXPCCTMM-CQSZACIVSA-N 293.773 3.380 70 20 CGID COc1ccc(C(=O)NC2(c3ccccc3)CCC2)c(O)c1 218423933 UPEBUPCRWPWUHO-UHFFFAOYSA-N 297.354 3.210 70 20 CGID CCc1ncnc(NC[C@]2(N(C)C)CCC[C@@H](C)C2)c1F 217985773 BZGIEPJTRBWKCC-WBMJQRKESA-N 294.418 3.101 70 20 CGID CCC(CC)(CN)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1 161223101 SMQPDHJQFQVRCY-JKSUJKDBSA-N 288.435 3.204 70 20 CGID Cc1ccc2cc(C(=O)N[C@@H](C)C[C@@H]3CCCO3)ccc2n1 161410632 PRRBSIGBBCHKNI-BBRMVZONSA-N 298.386 3.231 70 20 CGID Cc1cccc([C@H](C)N[C@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 160187947 BLCMZPHUZURCFN-TUUVXOQKSA-N 259.393 3.459 70 20 CGID CC(C)CCNC(=O)N1CCOC2(CCCCCC2)C1 160645749 UTKKJMUJZPOFNQ-UHFFFAOYSA-N 282.428 3.167 70 20 CGID CCc1ccccc1C(=O)N[C@H](C)c1cccnc1 160671475 LBWXNISAPMYXRP-GFCCVEGCSA-N 254.333 3.135 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)OCc1cccnc1 159409143 KLOOOHORKINUAM-OLZOCXBDSA-N 273.357 3.298 70 20 CGID C[C@@H]1OCCN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)[C@@H]1C 159674978 WYGIVHRWVIBELQ-LYYZXLFJSA-N 279.424 3.229 70 20 CGID O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1ccc(F)c(F)c1 159676534 DHCWDEGVRAMRCC-NHYWBVRUSA-N 294.345 3.168 70 20 CGID CCN(CCCNC(=O)C1=CCCC1)c1ccccc1 159696939 RFPPYIVDHFSOLH-UHFFFAOYSA-N 272.392 3.130 70 20 CGID CS[C@H](C)CNC(=O)Nc1cccc(OC(F)F)c1 159890907 OLVBLMHTBNAPHC-MRVPVSSYSA-N 290.335 3.161 70 20 CGID COc1ccc(C(=O)N(CC(F)(F)F)C2CC2)c(F)c1 218220014 BVQKQZGMEAXXMS-UHFFFAOYSA-N 291.244 3.001 70 20 CGID CNCCC1CCN(Cc2coc3ccccc23)CC1 161112912 PJFUWHLTINMGQV-UHFFFAOYSA-N 272.392 3.254 70 20 CGID CC(C)(C)C[C@H](CO)Nc1cc(C(F)(F)F)ccn1 161425791 GCLPREGFJGQJGF-SNVBAGLBSA-N 276.302 3.309 70 20 CGID Cc1cccc(NC(=O)c2nn(-c3ccccc3)cc2O)c1 216916718 STVXGVHECRXMQT-UHFFFAOYSA-N 293.326 3.139 70 20 CGID CCCC[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)F)cc1 799985686 HEIPUPDLFAHIQV-SNVBAGLBSA-N 287.356 3.110 70 20 CGID C[C@@H](NC(=O)C(F)F)c1cccc(C(F)(F)F)c1 217636859 FEIDVESWXKFSHF-ZCFIWIBFSA-N 267.197 3.148 70 20 CGID Cc1cccc(C)c1OCCCN[C@@H]1CCN(C)[C@H](C)C1 161231690 HVZPOFDBODEVKB-IAGOWNOFSA-N 290.451 3.145 70 20 CGID Cc1ccc(C(=O)N2CCC[C@H](CC(C)C)C2)cc1N 161473595 QJDPFLZECVDWTQ-CQSZACIVSA-N 274.408 3.476 70 20 CGID CCCCCNC(=O)[C@H](C)SCc1c(CC)noc1C 160006057 PQDILYGXDGUURZ-LBPRGKRZSA-N 298.452 3.474 70 20 CGID CSc1ccsc1C(=O)NCC1(C2CC2)CC1 160109049 AJCJMUWNLDQVQZ-UHFFFAOYSA-N 267.419 3.390 70 20 CGID CCc1c(Cl)nc(C)nc1N[C@H]1CCO[C@H](C2CC2)C1 160384295 BCZUARCUSNCIBQ-AAEUAGOBSA-N 295.814 3.370 70 20 CGID CCCCn1ncc(C(=O)N2[C@@H](C)CCC[C@H]2C)c1C 160765528 HOHNNVWAXUBCTF-BETUJISGSA-N 277.412 3.395 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)[C@H](C)CC1CCCCC1 160850500 YSLMWSRRCOCZJE-OLZOCXBDSA-N 283.412 3.051 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cccc(NC(=O)C2CC2)c1 160965365 DPLKOUPGLVVSDS-YOEHRIQHSA-N 286.375 3.410 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)Cc2cccnc2)C1 159499571 NMWBGMICCGUZMS-CYBMUJFWSA-N 298.411 3.399 70 20 CGID CC[C@H](c1ccncc1)N(C)S(=O)(=O)CCC(C)(C)C 159742373 OQUMEDCCPWFZIR-CQSZACIVSA-N 298.452 3.231 70 20 CGID CCC(CC)CC(=O)Nc1sccc1C(=O)OC 159381660 GAXDXPWXTPZDIA-UHFFFAOYSA-N 269.366 3.300 70 20 CGID COc1ccc(C(=O)N(C)Cc2ccccc2)c(F)c1 218433391 UVSWJFJDSPJXID-UHFFFAOYSA-N 273.307 3.107 70 20 CGID CN(C(=O)C1C2CC3CC(C2)CC1C3)C1CCCC1 217800332 SEVYTUJDMPFVCN-UHFFFAOYSA-N 261.409 3.460 70 20 CGID CCn1cc(NC(=O)[C@H]2C[C@H]2c2sccc2C)cn1 161447592 GKELPJCNYROMRI-NEPJUHHUSA-N 275.377 3.015 70 20 CGID CC/C=C(/C)C(=O)NC[C@H]1[C@H]2Cc3ccccc3[C@H]12 161456202 DSQTWDVLNHMXCO-UMDGLKRYSA-N 255.361 3.045 70 20 CGID C[C@H](C1CC1)N(C)C(=O)c1cc(F)cc2cccnc12 160247368 XRPLFFCKFGZDND-SNVBAGLBSA-N 272.323 3.244 70 20 CGID O=C(O[C@@H](c1ccccn1)C(F)(F)F)C1CCCC1 160459613 OJASNXODWTYSDS-NSHDSACASA-N 273.254 3.418 70 20 CGID CCCCN(C)C(=O)[C@@H]1C[C@H]1c1sccc1C 160593332 RVQYIAQYMGXFCF-VXGBXAGGSA-N 251.395 3.419 70 20 CGID Cc1cc(F)cc(NC(=O)[C@H]2CCC(=O)C[C@@H]2C)c1 160662255 OIFOZPZOSVWOFM-HZMBPMFUSA-N 263.312 3.078 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H]2CC2(C)C)n1 160933346 JUALKAIPAKETOP-LLVKDONJSA-N 284.363 3.019 70 20 CGID CC(C)c1ccc(C(=O)NCc2ccc(F)cc2)cn1 159602548 JGWMEBHIUGMZHS-UHFFFAOYSA-N 272.323 3.274 70 20 CGID Cc1cc(C)c(C(=O)N[C@H]2CCOC3(CCCC3)C2)o1 159655073 QZOVBJXSRGHAOI-ZDUSSCGKSA-N 277.364 3.118 70 20 CGID Cc1ccccc1[C@@H](C)NCCc1c(C)noc1C 159465993 CQWHPAKYEUHMNT-GFCCVEGCSA-N 258.365 3.493 70 20 CGID CC[C@@H](NC(=O)c1ccc(Cl)cc1C)c1ncc[nH]1 218079817 RGPZGWKDOWYZEX-GFCCVEGCSA-N 277.755 3.253 70 20 CGID CCOC1CC(Nc2cccc(CN3CCCC3)c2)C1 159503580 CUMSCRURWDNPOH-UHFFFAOYSA-N 274.408 3.262 70 20 CGID CCCCc1noc(CN2CC[C@@H]3CCCC[C@@H]32)n1 159698069 DNEHHRVMKPCDCE-STQMWFEESA-N 263.385 3.177 70 20 CGID CN(Cc1cccc2ccccc12)[C@H](CN)C1CC1 159680355 RISGSKYVYIAIET-QGZVFWFLSA-N 254.377 3.009 70 20 CGID CCc1nc(CN[C@@H](CC)c2cccc(Cl)c2)n[nH]1 160298270 WXBKDFFXFGTLEK-LBPRGKRZSA-N 278.787 3.261 70 20 CGID CC(C)c1ccc([C@@H](F)CS(=O)(=O)Cl)cc1 1537958760 JFZGTKQMNCYKLS-NSHDSACASA-N 264.749 3.389 70 20 CGID O=C(C[C@@H]1C=CCCC1)Nc1cccc(S(=O)(=O)F)c1 809281404 WUGRXIGLHKQWLS-LLVKDONJSA-N 297.351 3.030 70 20 CGID CCc1ncc(NC(=O)CCCSC(C)(C)C)cn1 161010432 UBOMQUXHKOHZPE-UHFFFAOYSA-N 281.425 3.289 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1 161058980 ZPZBBNCQULBWTA-DOMZBBRYSA-N 292.354 3.213 70 20 CGID COc1ccc(NC(=O)c2cccc(C)c2F)cc1OC 161390983 RMGNOAUCGAIYAW-UHFFFAOYSA-N 289.306 3.404 70 20 CGID CC[C@@H]1CCC[C@H](NC(=O)NCCc2ccncc2C)C1 161463185 YNMNERWEGVBQLM-ZBFHGGJFSA-N 289.423 3.201 70 20 CGID C[C@@H](CC(=O)N(C)Cc1cccn1C)c1ccccc1 160749456 LMVLUVDLYBPYSH-AWEZNQCLSA-N 270.376 3.177 70 20 CGID Cc1cc(C)c(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)[nH]1 160953920 DDSITJTYFMIGBC-CQSZACIVSA-N 290.407 3.243 70 20 CGID CCOC(C)(C)CNc1nc(C(C)(C)C)ns1 159533489 QQCBZJLFIINTKR-UHFFFAOYSA-N 257.403 3.063 70 20 CGID Cc1ccc(C)c(CC(=O)NCC2(C3CC3)CC2)c1 159750491 FDNJRCRKBJZRGK-UHFFFAOYSA-N 257.377 3.152 70 20 CGID CNCC(=O)Nc1cccc(CSC2CCCCC2)c1 159398485 BMAIDWOLKGQEGB-UHFFFAOYSA-N 292.448 3.410 70 20 CGID CC[C@@H](C)CN(C)C[C@@H](O)c1cc2ccccc2o1 216913990 BXTXGQXPALZIHE-TZMCWYRMSA-N 261.365 3.444 70 20 CGID Cc1ccc2cccc(NC(=O)NCC(F)(F)F)c2n1 160533411 DAKPUOCLCPQPIQ-UHFFFAOYSA-N 283.253 3.227 70 20 CGID C[C@@H](CNCc1ccc(Cl)cc1F)CN1CCCC1 160820275 KQMCGUQBUIGPDL-LBPRGKRZSA-N 284.806 3.301 70 20 CGID CCc1ncc(NC(=O)N[C@@H]2CCC[C@H](C3CC3)C2)cn1 161210561 DCZMSNBGOSQZCG-QWHCGFSZSA-N 288.395 3.129 70 20 CGID CCCN(CCO)Cc1ccc(OC(F)F)c(Cl)c1 161236278 HOTOZIUPTZWPTG-UHFFFAOYSA-N 293.741 3.146 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1occc1C 160231586 VGCRBSDNQPNKIC-CYBMUJFWSA-N 271.316 3.014 70 20 CGID COc1ccc(NC(=O)[C@H](C)c2c(F)cccc2F)cn1 160376025 ZMFUAUFUAASRPW-SECBINFHSA-N 292.285 3.111 70 20 CGID CSC[C@H](CCO)N[C@H](Cc1ccc(C)cc1)C(C)C 160394756 LJVICMQUHOVGNP-DLBZAZTESA-N 295.492 3.266 70 20 CGID C[C@H](NC[C@H](C1CCCCC1)N(C)C)c1cncc(F)c1 160412715 IHODBVOJARANFT-SUMWQHHRSA-N 293.430 3.382 70 20 CGID CCCCOc1ccc(C(=O)N[C@@H](CCO)C(C)C)cc1 160609515 FVXSXRJTCNHVAU-INIZCTEOSA-N 293.407 3.002 70 20 CGID Cc1ccc(C)c(OCCn2cnc(C(C)C)cc2=O)c1 160734639 NXASXVLURKDAHK-UHFFFAOYSA-N 286.375 3.063 70 20 CGID CCN(CC)C(=O)C[C@@H](C)N[C@@H](C)Cc1ccccc1C 160771963 LAPZIIWLZBZDOU-JKSUJKDBSA-N 290.451 3.163 70 20 CGID CCO[C@H](C)C(=O)N[C@H](c1cccc(C)c1)c1ccccn1 159816117 MWERCXUOTZSNHT-RHSMWYFYSA-N 298.386 3.021 70 20 CGID CC1(C)CC(NCc2ccc(C(N)=O)cc2)CC(C)(C)C1 159723025 WTNYSGHRHRYOOU-UHFFFAOYSA-N 288.435 3.480 70 20 CGID C[C@@H]1CCC[C@@H](CNCc2nc3ccccc3n2C)C1 218133657 RYJVBHJIKYGBKJ-ZIAGYGMSSA-N 271.408 3.489 70 20 CGID COC[C@@H](C)CNc1ncc(Cl)cc1Br 159580593 WUZKDAHASHOSSP-ZETCQYMHSA-N 293.592 3.192 70 20 CGID CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1CCCCO1 161051662 SONOYZQTTYGFPC-RDBSUJKOSA-N 267.413 3.277 70 20 CGID CC(C)c1ccc(CN(C)CCCCS(C)(=O)=O)cc1 161147533 BDRCVEPOPPRYTC-UHFFFAOYSA-N 297.464 3.067 70 20 CGID Cc1cccc(O[C@H](C)CNC(=O)c2ccc(C)c(N)c2)c1 161166600 QXBXJABYQHJRQR-CQSZACIVSA-N 298.386 3.083 70 20 CGID CCN(Cc1ccccn1)[C@@H](C)c1nc(C(C)C)no1 161182003 ZJOJQHSBWIOXOB-LBPRGKRZSA-N 274.368 3.171 70 20 CGID COc1ccc([C@@H](C)N(C)C(=O)c2cccc(F)n2)cc1 161320239 WLBGCMCJSNQFLE-LLVKDONJSA-N 288.322 3.063 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)C2CC=CC2)o1 161335836 MNWIQUYRBQDOIQ-AWEZNQCLSA-N 275.348 3.056 70 20 CGID CC1(NC(=O)NCCc2cc3ccccc3o2)CCC1 161446149 BPUWDKZMJLBXOP-UHFFFAOYSA-N 272.348 3.217 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)NCCC1=CCCC1 161454080 ZFOAGDLXAJNXDF-LLVKDONJSA-N 276.380 3.402 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)CCCCSC 160075776 HCWMTMWPDFRSNI-CQSZACIVSA-N 293.432 3.332 70 20 CGID CCC(CC)c1cc(C(=O)N(C)Cc2cccn2C)on1 160407358 FBRJJCGYWRDIDU-UHFFFAOYSA-N 289.379 3.189 70 20 CGID C[C@H](CC(=O)N(C)CC(F)(F)F)c1ccc(F)cc1F 160730023 UXSKWKTVOZEPHR-MRVPVSSYSA-N 295.251 3.479 70 20 CGID CC(C)N(CCSCc1ccccn1)C(C)C 160961629 YIVULPHTWQUEGY-UHFFFAOYSA-N 252.427 3.434 70 20 CGID CO[C@@H](C)CC(=O)N1C[C@H](C)CSc2ccccc21 159634103 JLNXWZQEBNQATE-RYUDHWBXSA-N 279.405 3.186 70 20 CGID CCCCSCCC(=O)N[C@H]1COc2ccccc2C1 159854724 UQJIRWXXNXTUHL-CQSZACIVSA-N 293.432 3.030 70 20 CGID CC(C)c1ccc([C@H](C)CC(=O)NCc2ncc[nH]2)cc1 159865212 OQUUCXDPUAVCDA-CYBMUJFWSA-N 285.391 3.343 70 20 CGID CCOc1ccc([C@@H](C)N[C@@H](COC)C(C)C)cc1OC 159970103 LKIGMUXSXJRFAQ-HIFRSBDPSA-N 295.423 3.416 70 20 CGID C[C@H](CCc1ccco1)NC[C@](C)(O)c1ccsc1 159976670 RNXVBQCPRHBCIN-DOMZBBRYSA-N 279.405 3.160 70 20 CGID COc1ccc2c(c1)[C@@H](N[C@@H]1CCOC(C)(C)C1)CC2 159926614 XFNHYXJLUSFEMZ-CJNGLKHVSA-N 275.392 3.230 70 20 CGID Cc1ccc([C@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)o1 161127035 BMKJRCPKYKPEMF-MJBXVCDLSA-N 250.386 3.111 70 20 CGID c1cc(CNCc2cccc3cc[nH]c23)c2c(c1)OCO2 218125276 WFEHFPQDDNHVHC-UHFFFAOYSA-N 280.327 3.186 70 20 CGID O=S(=O)(Cl)[C@H]1CCCC[C@@H]1c1ccccc1 88251585 RJCAPJKKRJGVKO-NEPJUHHUSA-N 258.770 3.281 70 20 CGID COc1ccc(Cl)c(NC(=O)C[C@@H](C)SC)c1 161185156 XVXFYOSOGWCBMV-MRVPVSSYSA-N 273.785 3.429 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@H]1c1c(F)cccc1F 160090260 OYMHLNMUUIRKTP-VXGBXAGGSA-N 291.341 3.375 70 20 CGID CCc1nc(CN[C@@H](c2cccc(F)c2)C(C)(C)C)n[nH]1 160483844 VWXWUAJGKADUPZ-HNNXBMFYSA-N 290.386 3.383 70 20 CGID CCc1ccccc1C(=O)N(C)CCOc1ccccc1 160564323 WXMHQXYEEKUEIX-UHFFFAOYSA-N 283.371 3.400 70 20 CGID CS[C@@H](C)CC(=O)N1CCC[C@@H]1C1CCCC1 160708671 KVNFTQQEKFCGSY-WCQYABFASA-N 255.427 3.309 70 20 CGID CN(Cc1ccccc1Cl)Cc1cnc2cnccn12 160817251 LBIRSEQDPSZTEU-UHFFFAOYSA-N 286.766 3.015 70 20 CGID CCCCc1nc(Cn2cnc(C(C)C)cc2=O)cs1 160817996 JPTATTZHKABSJY-UHFFFAOYSA-N 291.420 3.214 70 20 CGID CCc1ccc([C@@H](CO)Nc2ccnc(C(C)C)n2)cc1 160908546 SQNUOECSFHEBKM-OAHLLOKOSA-N 285.391 3.308 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)c1ccccc1F 160956585 IXFBREGCMNDGIW-SNVBAGLBSA-N 291.347 3.279 70 20 CGID C[C@H]1CCCN(C(=O)N[C@H]2CCCc3cc(N)ccc32)C1 159440600 LDSMYQMFZXJNEJ-LRDDRELGSA-N 287.407 3.088 70 20 CGID C[C@@](O)(CN[C@H]1CCc2cc(F)ccc21)c1ccsc1 159871967 HVZAXYVJBWLNFH-JKSUJKDBSA-N 291.391 3.372 70 20 CGID Cc1cccc([C@H](NC(=O)C(C)C)c2ccccn2)c1 159720214 NGXLJIULTNNCFR-INIZCTEOSA-N 268.360 3.252 70 20 CGID Cc1cnc([C@@H](C)NC(=O)N[C@@H](C)CC(C)C)s1 159394295 FRIPOHYDSZTSRT-GXSJLCMTSA-N 269.414 3.246 70 20 CGID Cc1ccc(C(=O)N(C)CCOCc2ccccc2)s1 159387858 NUPONRSBILIAHI-UHFFFAOYSA-N 289.400 3.345 70 20 CGID Cc1ccccc1NC(=O)N(C)[C@@H]1CCCc2c1cnn2C 159580013 DMYATXNLGWREST-OAHLLOKOSA-N 298.390 3.270 70 20 CGID COc1ccc([C@@H](NC[C@@H]2CCCN(C)C2)C2CC2)cc1 217566849 LGHUHRRNRCXRIY-KSSFIOAISA-N 288.435 3.078 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2nc(C)cs2)n1 160250918 HUOGONLDKFXFMT-CQSZACIVSA-N 273.405 3.492 70 20 CGID CC(C)N(CCSCC(=O)c1cccn1C)C(C)C 161018104 ZJOKBXRXNYPLND-UHFFFAOYSA-N 282.453 3.060 70 20 CGID CC(=O)Nc1ccc(C)c(NC(=O)N[C@@H](C)C2CCC2)c1 161047642 AZIXWLFVPXILKT-NSHDSACASA-N 289.379 3.264 70 20 CGID CC1(C)CCC(C(=O)N2CCO[C@@H](c3ccco3)C2)CC1 161096405 ABEZAEYKJAAYQD-OAHLLOKOSA-N 291.391 3.396 70 20 CGID COc1ccc([C@H](C)NCCc2ccc3c(c2)OCO3)cc1 161145172 ALBQLMAPFNMYCN-ZDUSSCGKSA-N 299.370 3.317 70 20 CGID CC(C)n1nccc1C(=O)N1CCC[C@@H]1c1ccccc1 161178696 FAOQJGZOPDHTRH-OAHLLOKOSA-N 283.375 3.441 70 20 CGID CCc1ccc(CC(=O)N(Cc2ccncc2)C2CC2)cc1 161470624 CFSBDWXDZVVHLW-UHFFFAOYSA-N 294.398 3.378 70 20 CGID CC(C)CC[C@@H](C)NC[C@@](C)(O)c1ccsc1 160044470 VZNINDIATOILJZ-TZMCWYRMSA-N 255.427 3.370 70 20 CGID COc1ccnc(CN2CCC[C@H]2c2cccc(C)n2)c1 160388633 MCQAFMUTBJDSJF-KRWDZBQOSA-N 283.375 3.131 70 20 CGID Cc1cncc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1 159471310 JEOLIICJPCJSCR-KRWDZBQOSA-N 280.371 3.200 70 20 CGID Cc1ccc(CNCc2cccc3cc[nH]c23)cn1 218113932 YNUHMTVYWVKELP-UHFFFAOYSA-N 251.333 3.161 70 20 CGID CC[C@H](C)CN(C)C[C@@H](O)c1cc2ccccc2o1 216914011 BXTXGQXPALZIHE-GXTWGEPZSA-N 261.365 3.444 70 20 CGID CC[C@H](C)[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1 218775629 PZGMQAZGFUZPFS-OUCADQQQSA-N 285.815 3.104 70 20 CGID CC[C@H](O)CCNCc1ccc(F)c(C(F)(F)F)c1 160159009 PFHQULVSCTVCCW-JTQLQIEISA-N 279.277 3.095 70 20 CGID COc1cccc([C@@H](C)NC[C@H]2CCC(C)(C)O2)c1 160325132 JDAFLXKXSUYLKJ-IUODEOHRSA-N 263.381 3.303 70 20 CGID CCCO[C@@H]1CCCN(CCCN2CCCCC2)CC1 161026237 GGUDAFMBVBCIMV-QGZVFWFLSA-N 282.472 3.144 70 20 CGID O=C(NC1(c2ccccc2)CCC1)c1ccccc1O 218423829 FLEGQMHFEVYYFO-UHFFFAOYSA-N 267.328 3.201 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCN1C1CCCC1)c1ccccc1 217937311 VVELMJUFCUENGZ-PBHICJAKSA-N 286.419 3.271 70 20 CGID CC(C)CCS(=O)(=O)N(C)CCCCc1ccccc1 216907075 PIIDRAGXPKUISH-UHFFFAOYSA-N 297.464 3.317 70 20 CGID CN(C(=O)NCCc1cccc(F)c1)C1CCCCC1 217435305 JVSIPXQXIDOOIF-UHFFFAOYSA-N 278.371 3.342 70 20 CGID CCNCC1CCN(C(=O)[C@@H]2[C@H](C=C(C)C)C2(C)C)CC1 161015457 NSORJZIBHUDLPX-HOTGVXAUSA-N 292.467 3.073 70 20 CGID COCCOc1cccc(NC(=O)N[C@H](C)C2CCC2)c1 161365838 VMEGCDAFMLKRCC-GFCCVEGCSA-N 292.379 3.022 70 20 CGID COc1cc(N[C@H](C)c2cscn2)ccc1F 160048691 HQTMZDFFKCQUDG-MRVPVSSYSA-N 252.314 3.464 70 20 CGID Cc1cc(Br)c(F)cc1NCC[C@@H](C)O 160207194 OLKVNOPKOQFVNK-MRVPVSSYSA-N 276.149 3.079 70 20 CGID CSC[C@@H](CCO)N[C@H](Cc1cccc(C)c1)C1CC1 160394224 VMADDRGWTZAAHE-IAGOWNOFSA-N 293.476 3.020 70 20 CGID CC[C@H](NC(=O)CCc1ccoc1)c1c(C)noc1C 160519629 MELAQQKVYZZZRR-ZDUSSCGKSA-N 276.336 3.085 70 20 CGID CSC[C@H]1CCCN1C(=O)C[C@H](C)c1c(C)noc1C 160530546 SVAJIANZWJISGK-GXFFZTMASA-N 296.436 3.139 70 20 CGID COc1cccc(Cl)c1CC(=O)N[C@@H]1C=CCCC1 160686827 JSQJZESVJDQKMX-LLVKDONJSA-N 279.767 3.116 70 20 CGID CC1=C(C(=O)Nc2cnn(-c3ccccc3)c2C)CCCO1 160717149 HUHPZHIYNZSZKS-UHFFFAOYSA-N 297.358 3.204 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCOC(C)(C)C2)c(F)c1 160889378 RGFWSVBZVSTEMT-NSHDSACASA-N 280.343 3.213 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cccc(-c2nnco2)c1 160990874 RRXJTDQJTOBLMV-WFASDCNBSA-N 271.320 3.111 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H](C)C2CCN(C)CC2)C1(C)C 159804157 UDTVEACKGHSMBD-BHYGNILZSA-N 296.499 3.290 70 20 CGID CS[C@H](C)CC(=O)Nc1cccc(OC(F)F)c1 159478422 ZIIJYIUDILSLQL-MRVPVSSYSA-N 275.320 3.368 70 20 CGID COC(=O)[C@@H](Sc1ccncc1)c1ccccc1F 159914529 TVEXZKGMGLRFHT-ZDUSSCGKSA-N 277.320 3.227 70 20 CGID CC[C@@H](NC(=O)C[C@@H]1C=CCC1)c1c(C)noc1C 159948311 XDLNODNHPANNGR-CHWSQXEVSA-N 262.353 3.215 70 20 CGID CCSCC[C@H](C)NCc1cc(OC)c(O)c(OC)c1 160067874 RLOJBCKPHOYDKG-NSHDSACASA-N 299.436 3.031 70 20 CGID CCCCCCNC(=O)c1ccnc(Cl)c1F 161286349 HFKBTSYPAWEPLC-UHFFFAOYSA-N 258.724 3.184 70 20 CGID Cc1ccc(NC(=O)N(C)[C@H](C)c2cccnc2)cn1 161358403 LYIHGJGBZWDTEC-GFCCVEGCSA-N 270.336 3.010 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cnc(-c2ccccn2)s1 161485702 AFVWEXYODSKUOD-PHIMTYICSA-N 287.388 3.218 70 20 CGID Cc1nccc(NC(=O)NCC[C@H]2CCCCO2)c1Cl 160043618 FUCGYFJQAKKBKI-LLVKDONJSA-N 297.786 3.124 70 20 CGID C[C@H](CC(=O)NC[C@H]1CCc2ccccc21)c1ccncc1 160539529 WBYKKIONYMRGED-RHSMWYFYSA-N 294.398 3.421 70 20 CGID Cc1ccccc1C[C@@H](C)NC[C@H]1CCCC[C@@H]1O 160569394 VOALWFNMCUFDAN-OIISXLGYSA-N 261.409 3.067 70 20 CGID CN(C(=O)N[C@H]1CCO[C@@H](C2CC2)C1)C1CCCCCC1 160630692 PVNLZTVAWMGRBU-GOEBONIOSA-N 294.439 3.308 70 20 CGID CCOC(=O)c1ccc(CN(C)Cc2ccc(C)cc2)o1 160641029 NYJUBYKVLCEJAM-UHFFFAOYSA-N 287.359 3.397 70 20 CGID Cc1ccsc1CCCC(=O)N(C)Cc1cccnc1 159466815 YXAFTYZBDBJWFE-UHFFFAOYSA-N 288.416 3.433 70 20 CGID CC[C@@H](C)OCC(=O)Nc1ccccc1OCC(C)C 159681306 WMGNXIXDZDSQTP-CYBMUJFWSA-N 279.380 3.475 70 20 CGID CS[C@@H](C)CNC(=O)NCC(C)(C)CC(C)C 159516322 BOYJBDHUIRMEMW-NSHDSACASA-N 260.447 3.109 70 20 CGID CS[C@H](C)CC(=O)Nc1cc(-c2nnco2)ccc1C 159554036 JZCNYPZDSSANOC-SNVBAGLBSA-N 291.376 3.125 70 20 CGID COc1ccc2c(c1)[C@H](N[C@@H]1CCOC(C)(C)C1)CC2 159926345 XFNHYXJLUSFEMZ-CZUORRHYSA-N 275.392 3.230 70 20 CGID CC(C)[C@@H](CCO)NC(=O)c1ccc(C(C)(C)C)cc1 160707992 WWEZLROSJVOYIY-OAHLLOKOSA-N 277.408 3.121 70 20 CGID Cc1ccc(C)c([C@@H](C)N(C)C(=O)CCNC(C)C)c1 161307302 ULCHECRWQWZFMF-OAHLLOKOSA-N 276.424 3.211 70 20 CGID COc1ccc(OC)c([C@@H](C)N[C@@H](C)C2CCOCC2)c1 160011881 OQMSDBNEAOQKSZ-QWHCGFSZSA-N 293.407 3.170 70 20 CGID CC[C@@H](NC(=O)Cc1ccccc1F)c1c(C)noc1C 160016538 TWMLFBVNOCQHKL-CQSZACIVSA-N 290.338 3.241 70 20 CGID CCOc1cc(F)ccc1NC(=O)C[C@H](C)SC 160137840 AMVXQONIWJHPOM-VIFPVBQESA-N 271.357 3.305 70 20 CGID CSCCCCC(=O)N[C@H]1CCOC2(CCCC2)C1 160139480 BJLHZCKXJFJHSE-ZDUSSCGKSA-N 285.453 3.128 70 20 CGID CC(C)Oc1ccccc1C(=O)N(C)Cc1cccn1C 160485996 ZJWIYXLWYTUTJB-UHFFFAOYSA-N 286.375 3.085 70 20 CGID CCCC1(CNC(=O)Nc2cccc([S@](C)=O)c2)CC1 160547402 XGYZKSADOSMWOQ-HXUWFJFHSA-N 294.420 3.126 70 20 CGID CCC(CC)CNC(=O)N1CCC[C@H](N2CCCC2)CC1 160549504 PVHJGJCTBSASDG-INIZCTEOSA-N 295.471 3.083 70 20 CGID C[C@H]1CCCN(C(=O)[C@H](C)c2c(F)cccc2F)C1 160965600 PYLXUEJMFSRIGR-WDEREUQCSA-N 267.319 3.327 70 20 CGID Cc1cccc([C@H]2CCCN2C[C@H](O)c2ccccc2)n1 159807706 ZOADXENTSQSYEW-MSOLQXFVSA-N 282.387 3.261 70 20 CGID CC[C@H](NCCN(C)CCOC)c1ccc(Cl)s1 159411440 RIQFPYYNNURYSM-NSHDSACASA-N 290.860 3.020 70 20 CGID CC[C@@H](C)OCC(=O)N1CCC[C@@H]1c1cccc(F)c1 159871218 CJPSMKCBSGGLKX-IUODEOHRSA-N 279.355 3.304 70 20 CGID CCO[C@H](C)c1noc(CN[C@H](C)c2ccccc2C)n1 159699504 DZYOXCVHYKXOMX-CHWSQXEVSA-N 289.379 3.326 70 20 CGID O=C([C@H]1CCCCO1)N(Cc1ccccc1)Cc1ccco1 159939193 CPSMUFQDNPHNCW-QGZVFWFLSA-N 299.370 3.378 70 20 CGID CCCC(=O)Nc1cccc(NC(=O)[C@@H]2CC2(C)C)c1 159391360 IOGIMOFZMLJZLF-ZDUSSCGKSA-N 274.364 3.410 70 20 CGID CCOC1CC(Nc2ccc(-c3nnco3)cc2C)C1 160200823 UFYPRQGVMUXTBX-UHFFFAOYSA-N 273.336 3.024 70 20 CGID COc1cccc(COC(=O)c2cccc(C)c2F)c1 161395971 QOHIKFLQBPHMJA-UHFFFAOYSA-N 274.291 3.500 70 20 CGID CC[C@@H](N[C@@H](C)C(=O)NC(C)(C)C)c1ccc(F)cc1F 161025013 UKMFEVZJVVPEPG-IINYFYTJSA-N 298.377 3.309 70 20 CGID COCCC1(CNC(=O)N(C)[C@@H]2CCC[C@H](C)C2)CC1 161028384 KRGCZIDPPUAWMJ-UONOGXRCSA-N 282.428 3.023 70 20 CGID c1ccn2c(CN3CCS[C@@H]4CCCC[C@@H]43)cnc2c1 161441324 YUIQXBVLJVTHCC-LSDHHAIUSA-N 287.432 3.194 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCCOc2ccc(F)cc21 160075125 DFWVKTFKALBEPO-CZUORRHYSA-N 294.414 3.359 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@@H]1CCCc2sccc21 160185869 QRIPUDIZSFGOPS-WCQYABFASA-N 281.421 3.447 70 20 CGID CC[C@H](NC[C@@H](CC)Oc1ccccc1F)[C@@H]1CCOC1 160330874 XHDPNUORHSDRME-FMKPAKJESA-N 295.398 3.388 70 20 CGID C[C@@H](NC1CCN(C2CCCC2)CC1)c1cncc(F)c1 160496226 NFZFCNPGUULXDG-CYBMUJFWSA-N 291.414 3.278 70 20 CGID CCOc1ccc(Cl)cc1[C@H](C)NCC(C)(C)O 160609543 KOCCQECKFOORTE-JTQLQIEISA-N 271.788 3.160 70 20 CGID Cc1ccc2oc(CN(Cc3ccco3)C(N)=O)cc2c1 160782497 RARXMIQNPNYADZ-UHFFFAOYSA-N 284.315 3.415 70 20 CGID CN(CCc1ccncc1)C(=O)C1CCC(C)(C)CC1 159625679 GBVHSHHBRCDTAT-UHFFFAOYSA-N 274.408 3.299 70 20 CGID CC(=O)O[C@H](C)c1ccc(F)c(C(F)(F)F)c1 159449335 IJGGFCKDXGFLSE-ZCFIWIBFSA-N 250.191 3.469 70 20 CGID CCc1nc2cc(NC(=O)CO[C@@H](C)CC)ccc2o1 159461476 BOYJCGNOFIOITG-JTQLQIEISA-N 276.336 3.144 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(F)cc1F 159777588 VEOPPGOPMIQSLE-NOZJJQNGSA-N 253.292 3.273 70 20 CGID C[C@@H]1C[C@@H]1c1ccc(CN[C@@H]2CCOC(C)(C)C2)o1 160553853 ACQVNNZKJCFYLR-BZPMIXESSA-N 263.381 3.450 70 20 CGID CC(C)S(=O)(=O)CCCNC(C)(C)CC(C)(C)C 160899994 FBHNJEBFLMYZQT-UHFFFAOYSA-N 277.474 3.004 70 20 CGID O=C(NCc1cccc(F)c1)Nc1cc(Cl)ccn1 217314818 AZLOLQVKEMQNHO-UHFFFAOYSA-N 279.702 3.196 70 20 CGID CC(=O)c1ccc(OCC[C@@H]2CCCCN2C)cc1 218178380 NUZLONUBJHJPII-HNNXBMFYSA-N 261.365 3.142 70 20 CGID C[C@@H]1CC/C(=C/C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 809281111 GRAZVZIMLLZSDF-UBYNWHESSA-N 297.351 3.030 70 20 CGID Cc1cc(O)ccc1NC(=O)[C@H](C)Sc1ccccn1 161019183 IQXCITFVEYUSIL-NSHDSACASA-N 288.372 3.215 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CCc1cccnc1 161296099 VTBBACWKFZDMDA-HZPDHXFCSA-N 274.408 3.441 70 20 CGID CSC[C@H](C)C(=O)N1CCc2c(Cl)cccc21 161472584 PGLFXNQSTLNGCN-VIFPVBQESA-N 269.797 3.228 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1c(C)cccc1C 160036248 LMEOZCAEUYAOHE-UHFFFAOYSA-N 278.396 3.224 70 20 CGID CC[C@@H](NCCC1CCN(CC(F)(F)F)CC1)C1CC1 160036604 GBYKQMUPMINFLI-CQSZACIVSA-N 292.389 3.429 70 20 CGID CC[C@H](CN[C@H](C)c1cnccn1)Oc1ccccc1F 160316233 VRFRAQIAKUBHER-CHWSQXEVSA-N 289.354 3.124 70 20 CGID C[C@H](C(=O)N1CCCCC1)c1c(F)cccc1F 160446075 UXZUGWDSJBRSCW-JTQLQIEISA-N 253.292 3.081 70 20 CGID C[C@@H](CO)N(C)C(=O)c1ccc(C2CCCCC2)cc1 160542555 OJYPNTVYMBJSAE-ZDUSSCGKSA-N 275.392 3.187 70 20 CGID CCC(CC)n1nccc1C(=O)NCCc1cccs1 160640604 GLKVMKRWHFZRJG-UHFFFAOYSA-N 291.420 3.278 70 20 CGID CC1(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)CCC1 160643310 MXDRJRGFARVKOX-CYBMUJFWSA-N 265.397 3.175 70 20 CGID CC[C@H](NCCCCc1nc(C)cs1)[C@@H]1CCOC1 160695102 FEPDJTVHCHHRAS-KGLIPLIRSA-N 282.453 3.179 70 20 CGID CN(C(=O)Nc1ccc(Cl)cc1F)[C@@H]1CCSC1 159400241 XAPKWQABKOYGEL-SECBINFHSA-N 288.775 3.448 70 20 CGID C[C@@H](c1cc(Cl)ccc1Cl)N(C)C[C@@H](C)O 159457130 HBUNTEIHOBBZTD-BDAKNGLRSA-N 262.180 3.367 70 20 CGID CC1CCC(=CC(=O)NC[C@H](O)c2ccsc2)CC1 159668577 QAJBDUAVJMIATJ-IAXJKZSUSA-N 279.405 3.034 70 20 CGID C[C@@H]1CCC[C@H](N(C)C(=O)c2ccc(CN(C)C)cc2)C1 159908167 CGHIXZSOPQFFCR-PBHICJAKSA-N 288.435 3.399 70 20 CGID CC(C)COCCCNC(=O)[C@@H](C)OC1CCCCCC1 159710545 DDFMHXLBHWCYQO-OAHLLOKOSA-N 299.455 3.293 70 20 CGID COCc1nc(C)c(C(=O)NC[C@@H]2CCCC[C@H]2C)s1 159985039 QRXHYTNQLBBIHP-PWSUYJOCSA-N 296.436 3.154 70 20 CGID CCOC(=O)CCCN(C)[C@@H](C)c1ccc(F)cc1 160958005 WKWLMSJMJIVEEM-LBPRGKRZSA-N 267.344 3.162 70 20 CGID Cc1cccc(CCNC(=O)N[C@H]2CCCC[C@H]2C)c1 217406449 ORMTVBCLYSPKSQ-ZBFHGGJFSA-N 274.408 3.415 70 20 CGID CCC1(CC)CCN(C(=O)c2ccncc2F)CC1 159795258 OGKUNPZSUNZATH-UHFFFAOYSA-N 264.344 3.263 70 20 CGID CC[C@@H](C)OCC(=O)Nc1ccc(COC(C)C)cc1 161042232 ZYNGURUYKGISPU-CYBMUJFWSA-N 279.380 3.365 70 20 CGID Cc1nc(COC(=O)CC[C@@H]2CCCCO2)c(C)s1 161294025 PIBLRCWIAHLPII-LBPRGKRZSA-N 283.393 3.152 70 20 CGID CCC[C@@H](C)NC(=O)[C@H](C)SCc1c(CC)noc1C 160040907 BFJPXAQTQNELQV-PWSUYJOCSA-N 298.452 3.472 70 20 CGID CC[C@@H](Nc1ccn(C)n1)c1ccc(F)cc1F 160699434 FUHAANZYCAKXQP-GFCCVEGCSA-N 251.280 3.262 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@H](C)Cc1ccc(Cl)cc1 160798739 BHCCUNCIYDEWAI-IUODEOHRSA-N 297.826 3.042 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)c2cocn2)C1 159651023 ZGGRISFFWWGQHW-JTQLQIEISA-N 274.345 3.063 70 20 CGID COc1cc(C(=O)N[C@H](C)c2cccc(O)c2)ccc1F 159699400 IIHZOGNAXUYJBR-SNVBAGLBSA-N 289.306 3.031 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1ccnc(SC)c1 159761434 DVYJVXHTENUJMQ-CMPLNLGQSA-N 264.394 3.112 70 20 CGID C[C@@H](NC(=O)CC1CCSCC1)c1cccc(O)c1 160498969 IAYOYEPJTKIBTL-LLVKDONJSA-N 279.405 3.103 70 20 CGID CCc1nc(CN[C@H](C)c2c(F)cccc2Cl)n[nH]1 160507430 QGPPZHFURSBDGO-MRVPVSSYSA-N 282.750 3.010 70 20 CGID Cc1cc(C(=O)N(C)Cc2cccnc2)cc(C)c1F 161060822 WTKBPBQEIGBFNH-UHFFFAOYSA-N 272.323 3.110 70 20 CGID CCCCCNC(=O)NCCCOc1ccc(C)cc1 217297860 UKEDBGZXORNCQI-UHFFFAOYSA-N 278.396 3.253 70 20 CGID C[C@@H](CN[C@H](C)c1cncs1)N(C)Cc1ccccc1 160862220 DRPAJBUKHALZNH-UONOGXRCSA-N 289.448 3.314 70 20 CGID C[C@H]1CC[C@H](CC(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237750 IVJQULABODPCMT-QWRGUYRKSA-N 299.367 3.110 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@@H](C)Cc1cccc(Cl)c1 161150152 PBQGMWRXLGYZJF-WFASDCNBSA-N 297.826 3.042 70 20 CGID Cc1ccc(NC(=O)NCc2ccccc2OC(C)C)cn1 161375502 VZPJUMNZEZOFPT-UHFFFAOYSA-N 299.374 3.499 70 20 CGID O=C(Nc1cc(-c2ccccc2)on1)NC1CC=CC1 161381808 KSUMURCJZRHSFF-UHFFFAOYSA-N 269.304 3.182 70 20 CGID CN(C(=O)c1ccc2[nH]ccc2c1)c1ccc2c(c1)OCO2 160166852 GPFXZUABOMJGGE-UHFFFAOYSA-N 294.310 3.173 70 20 CGID CSC[C@H](CCO)N[C@@H](Cc1ccc(F)cc1)C(C)C 160279171 GEWWQTLFNJEYHO-HOTGVXAUSA-N 299.455 3.096 70 20 CGID CC[C@H](NC(=O)CC[C@H]1CC[C@H](C)O1)c1c(C)noc1C 160418911 YQCSJXKPTPHURB-GDLCADMTSA-N 294.395 3.206 70 20 CGID CC1(C)C[C@H](NCc2c(Cl)nc3ccccn23)CCO1 160432534 LUACBMQTYBMZEW-LLVKDONJSA-N 293.798 3.035 70 20 CGID CCCC1(CNC(=O)c2cc(C(C)=O)cs2)CC1 160657324 ROCDDHAOLPOYGK-UHFFFAOYSA-N 265.378 3.261 70 20 CGID CCOc1ccc(CCC(=O)Nc2cccc(F)n2)cc1 160672174 IZQRZNNOXMRIAE-UHFFFAOYSA-N 288.322 3.191 70 20 CGID CN(C)C1(CNCc2cccc3c2NCCC3)CCCC1 160675524 YGYXTTCNBARRDA-UHFFFAOYSA-N 287.451 3.009 70 20 CGID COC[C@@H](C)NCc1ccnc(O[C@@H](C)CC(C)C)c1 160836760 XNXDBTRXWYSOFJ-KGLIPLIRSA-N 280.412 3.020 70 20 CGID C[C@H](CC(=O)N(C)CCc1cccs1)c1ccncc1 160898042 OXDZJSUNPZQEOD-CYBMUJFWSA-N 288.416 3.338 70 20 CGID O=S(=O)(c1cccs1)N1CCC[C@H]2CCCC[C@H]21 159458268 AVBBZCDMZDTYNX-VXGBXAGGSA-N 285.434 3.091 70 20 CGID Cc1cccc([C@H](C)C(=O)NCCN2CCCCCC2)c1 159654354 MTKUHOBFJLOSKS-INIZCTEOSA-N 288.435 3.091 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@H]1c1ccc(F)cc1F 159869145 OAXMTHGDHAQNBQ-UONOGXRCSA-N 291.341 3.375 70 20 CGID CO[C@@H](CNC(=O)CCc1ccc(F)cc1F)C(C)(C)C 159500271 LRSSTNJEGHGZMF-AWEZNQCLSA-N 299.361 3.075 70 20 CGID CCC(CC)c1cc(C(=O)N(C)Cc2ccncc2)on1 159515676 SRUZBTSGXRZQKK-UHFFFAOYSA-N 287.363 3.245 70 20 CGID CCOC(=O)[C@@H](c1ccccc1)N(C)Cc1ccoc1 218170913 XEEDUMZEFZMUKA-OAHLLOKOSA-N 273.332 3.016 70 20 CGID O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1ccc(F)cc1 159669807 MTYRQCVJABNBFJ-WFASDCNBSA-N 276.355 3.029 70 20 CGID C[C@@H](NCc1ccc(F)c(C(F)(F)F)c1)[C@H]1CCOC1 160153844 KWMKWXOBHNWMSB-KOLCDFICSA-N 291.288 3.359 70 20 CGID Cc1nnc(NC(=O)C[C@@H]2CCCCC2(C)C)s1 160161674 RKYMFDZAFVBWRZ-JTQLQIEISA-N 267.398 3.392 70 20 CGID CCc1nc(CN[C@H](C)c2cccc(C(F)(F)F)c2)n[nH]1 160271266 GUFIDGLSSSIHBJ-SECBINFHSA-N 298.312 3.237 70 20 CGID CC(C)[C@@H](NC(=O)[C@H]1CCCNC1)c1ccccc1Cl 160830868 YSVKFKOYRANXON-SWLSCSKDSA-N 294.826 3.153 70 20 CGID Cc1nc(C2(NCCC3CCCC3)CCCC2)no1 159683518 XVGRUSTYINOZJA-UHFFFAOYSA-N 263.385 3.317 70 20 CGID CCCn1nccc1CNc1ccc2c(c1)OC(F)(F)O2 159962311 SNNIKLUVAXMEDF-UHFFFAOYSA-N 295.289 3.227 70 20 CGID C[C@@H](C1CC1)N(Cc1ccccc1)Cc1cc[nH]n1 159685201 ARIHTUXWCYBJSY-ZDUSSCGKSA-N 255.365 3.210 70 20 CGID Fc1cc(Cl)cc(CNC2CCN(C3CC3)CC2)c1 160885439 IDLKUEIDZHKKAJ-UHFFFAOYSA-N 282.790 3.196 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1 161112195 QXLNAJPHKDMFMR-KCXAZCMYSA-N 264.388 3.349 70 20 CGID CC1(O)CCN(Cc2csc(-c3ccccc3)n2)CC1 161224206 UFYWDUGWTBVQDG-UHFFFAOYSA-N 288.416 3.157 70 20 CGID Cc1ccc(C(=O)N2CCC(C(C)C)CC2)cc1N 161269830 VXUTUPNXRGIJRT-UHFFFAOYSA-N 260.381 3.085 70 20 CGID CC(C)=CCOC(=O)c1cnn(-c2ccccc2)c1C 217406266 CEKNCBRIFKXXDY-UHFFFAOYSA-N 270.332 3.304 70 20 CGID CCCOC(=O)c1c(F)cccc1Br 160199859 GGBGGRFZYGBOBA-UHFFFAOYSA-N 261.090 3.155 70 20 CGID CC[C@@H](c1ccccc1)S(=O)(=O)Cc1nccs1 161214866 PSKIBNZSTPUBOL-LBPRGKRZSA-N 281.402 3.209 70 20 CGID CCc1cc(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)sc1C 161325798 ZLNFNRHAWXLOSH-SECBINFHSA-N 291.420 3.011 70 20 CGID C[C@@H]1CC[C@@H](C)N1c1cnc2cc(F)c(F)cc2n1 161447265 UCOYEQUSECFPFM-RKDXNWHRSA-N 263.291 3.285 70 20 CGID CCOC(=O)CN(Cc1ccsc1)c1ccccc1 160172302 LACGHJHDEWXZLY-UHFFFAOYSA-N 275.373 3.318 70 20 CGID COc1ccccc1[C@@H]1CCN(C(=O)OC(C)(C)C)C1 160517581 IXHHRMWJGKRNHR-GFCCVEGCSA-N 277.364 3.420 70 20 CGID CS[C@H](C)CC(=O)N(C)c1ccc(C)cc1C 160556962 ZWJUXBGKJXYVMU-GFCCVEGCSA-N 251.395 3.408 70 20 CGID CC1(C)C[C@@H](Nc2nc3cc(F)ccc3o2)CCO1 160716066 RXRBVVMIHCUYRE-JTQLQIEISA-N 264.300 3.336 70 20 CGID CCCCCNC(=O)NC1(c2cccc(F)c2)CC1 160818989 BPKWOJZYDITRPX-UHFFFAOYSA-N 264.344 3.304 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H](C)CC)n1 160942851 DXJHOWIRZPYTRX-SNVBAGLBSA-N 272.352 3.019 70 20 CGID C[C@@H]1CC(NC(=O)N[C@@H]2CCCCC2(C)C)C[C@@H](C)O1 159938134 PAVQLDMMJCDMQV-YRGRVCCFSA-N 282.428 3.210 70 20 CGID NC(=O)[C@@H](N[C@@H]1CCCc2cc(F)ccc21)c1ccccc1 159546649 ZIQLTHIQGKSDSV-SJORKVTESA-N 298.361 3.019 70 20 CGID CC[C@@H](NC(=O)c1cccc(OC)c1)c1c(C)noc1C 159943465 SAVJJMYCKDTAFL-CQSZACIVSA-N 288.347 3.181 70 20 CGID CC1(C)C[C@@H](Nc2cccc(C(F)(F)F)n2)CCO1 159780429 NDCRHLQQJQWOEY-VIFPVBQESA-N 274.286 3.470 70 20 CGID CCn1nccc1CNC[C@@H](c1ccccc1)C(C)C 159943945 YFNVSUBIWWDFKY-QGZVFWFLSA-N 271.408 3.432 70 20 CGID O=C(Nc1ccc(C(F)(F)F)nc1)N1CCCCC1 160739474 PAFPINVBRSFUCZ-UHFFFAOYSA-N 273.258 3.118 70 20 CGID CCCCC1CCC(C(=O)N2CCC(C)(O)CC2)CC1 161277434 KFAAMQXYLVBILB-UHFFFAOYSA-N 281.440 3.356 70 20 CGID CCc1ccccc1NC(=O)N[C@H]1CCOC(C)(C)C1 161036534 NOFDUBPEZVXTPS-ZDUSSCGKSA-N 276.380 3.328 70 20 CGID CC(=O)NCCCN(C)c1ccc(Oc2ccccc2)cc1 161085333 FMOJGSHLTGPJIL-UHFFFAOYSA-N 298.386 3.441 70 20 CGID CC[C@@H](S[C@H](CC)c1ccc(F)cc1F)C(N)=O 161363653 LLTQUXLLAQCAMQ-VXGBXAGGSA-N 273.348 3.413 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)cn1 161369070 RRQGKBPLPKJAMI-HUUCEWRRSA-N 285.322 3.207 70 20 CGID CCC(N)(CC)CNC(=O)[C@@H](C)c1ccc(Cl)s1 160442515 GZOBEPLRWUBJNJ-VIFPVBQESA-N 288.844 3.139 70 20 CGID CCC[C@H](C)C(=O)N[C@H](CC)c1c(C)noc1C 160484788 CTEAFERUUTYKOI-JOYOIKCWSA-N 252.358 3.295 70 20 CGID CCOC[C@@H](C)NCCOc1cccc(C(F)(F)F)c1 160495957 PAAJLFDTDRYNSS-LLVKDONJSA-N 291.313 3.099 70 20 CGID O=C(N[C@@H](c1cccc(F)c1)C1CCCC1)[C@@H]1CCCO1 160805898 FURFMUANICDFAQ-JKSUJKDBSA-N 291.366 3.352 70 20 CGID CS[C@H](C)CC(=O)Nc1nc(-c2ccccc2)ns1 160830292 DJQBHYMCUFWYQW-SECBINFHSA-N 293.417 3.285 70 20 CGID CC(C)(C)c1nsc(NC[C@@]2(C)CCCC[C@H]2O)n1 159828911 XNATVMXFSZSYGI-QMTHXVAHSA-N 283.441 3.189 70 20 CGID COCCn1ccc(N[C@H](C)c2ccccc2C)n1 159639206 ZSVGZEURISYWTO-CYBMUJFWSA-N 259.353 3.011 70 20 CGID C[C@@H]1CC[C@@H](NC(=O)NCc2ccc(O)c(F)c2)[C@H](C)C1 159861564 QDSWAGCZGDHZMI-JTNHKYCSSA-N 294.370 3.155 70 20 CGID C[C@H](c1ccc2ccccc2c1)N1CCC[C@@H](N)C1 217500199 BABCLJOAWKHQDX-CXAGYDPISA-N 254.377 3.324 70 20 CGID CC[C@@H](C)[C@@H](NCc1coc2ccccc12)C(=O)OC 161083785 AGRIRCMZMBGWMY-IAQYHMDHSA-N 275.348 3.110 70 20 CGID CCOc1ccc(NC2CCC(NC(C)=O)CC2)c(C)c1 161079419 VRHQWFMYDAJEBD-UHFFFAOYSA-N 290.407 3.253 70 20 CGID CC1(C)Cc2cccc(OCc3nccs3)c2O1 161122301 DVOBTHYAMPTFMN-UHFFFAOYSA-N 261.346 3.436 70 20 CGID c1cc2c(cc1[C@H](N[C@@H]1CCSC1)C1CC1)OCCO2 161123006 JCVOGCJFXKLUSS-CZUORRHYSA-N 291.416 3.004 70 20 CGID O=C(/C=C/c1cccs1)N[C@@H]1CCOC2(CCCC2)C1 161315206 KTMWAKRSFRUQHA-URWSZGRFSA-N 291.416 3.369 70 20 CGID CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(C)nc2)C1 161332193 SVOMEQMIQTYCGW-DGCLKSJQSA-N 279.409 3.186 70 20 CGID CC(C)Oc1ncccc1NC(=O)C[C@H](C)c1ccncc1 160075707 KAEQQQXPRNOZOQ-ZDUSSCGKSA-N 299.374 3.396 70 20 CGID CC[C@@H](SC)C(=O)O[C@H](c1ccccn1)C(F)(F)F 160106484 SWNFVGRHKXGHAM-NXEZZACHSA-N 293.310 3.370 70 20 CGID Cn1ccc(CNC(=O)C[C@H]2CCCCC2(C)C)c1 160424865 DTPAUQMRWRYYLH-CQSZACIVSA-N 262.397 3.248 70 20 CGID O=C(CCCN[C@H]1CCSC1)Nc1ccc(Cl)cc1 160801284 CPJYYLAUANPVID-ZDUSSCGKSA-N 298.839 3.154 70 20 CGID CS[C@H](C)CNC(=O)NCC1(Cc2ccccc2)CC1 160830701 WYDUKZJIEZKOOL-CYBMUJFWSA-N 292.448 3.060 70 20 CGID CCN(C(=O)c1cnn(-c2cc(C)ccc2C)c1C)C1CC1 160852997 AJUBIZAVEFZZQH-UHFFFAOYSA-N 297.402 3.422 70 20 CGID COc1ccc(C)cc1NC(=O)N[C@@H](C)C1CCC1 159413254 ZVVIXBOUGJCIAX-NSHDSACASA-N 262.353 3.314 70 20 CGID c1cnc2c(CN[C@H]3[C@H]4CCO[C@@H]4C34CCC4)cccc2c1 159541287 PBTNIFNJNDYMIP-NJAFHUGGSA-N 294.398 3.282 70 20 CGID CCOC(=O)CCCCN(C)c1ccccc1OCC 159390923 CMQJHGHPXIKDQU-UHFFFAOYSA-N 279.380 3.255 70 20 CGID CC(C)CCC(=O)N(C)CCOCc1ccccc1 159435719 MGTNHSZRSVQXDZ-UHFFFAOYSA-N 263.381 3.098 70 20 CGID CC(C)(CNC(=O)Cc1ccc(O)cc1)C1CCCC1 160081540 GUWCUJHYXMLULE-UHFFFAOYSA-N 275.392 3.267 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)cc1F 161022685 LLJCXDISAOAFLS-HIFRSBDPSA-N 292.354 3.213 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H]1CCc2ccc(OC)cc21 161172033 WXMHBYPVRRBNJZ-CRAIPNDOSA-N 288.435 3.147 70 20 CGID CCc1nn(C)c(Cl)c1C(=O)N(C)c1ccc(F)cc1 161280696 CTCPVJNYFLZZPW-UHFFFAOYSA-N 295.745 3.052 70 20 CGID CS[C@H](C)CNC(=O)[C@@H](C)Cc1cccc(Cl)c1 161375276 SPJMEILRLTZLTF-WDEREUQCSA-N 285.840 3.386 70 20 CGID CS[C@H](C)CC(=O)N(C)[C@@H](C)c1cccs1 160017508 XAXKDIQNJAUUQZ-ZJUUUORDSA-N 257.424 3.409 70 20 CGID CCc1ccc([C@@H](C)NC(=O)c2ccc(COC)o2)cc1 160139831 ZAHHEXYHKJPSIA-GFCCVEGCSA-N 287.359 3.479 70 20 CGID Cc1ccc(-c2nnc(NC(=O)C3CCCCCC3)[nH]2)o1 160211616 FUGBLPLXQVMFTJ-UHFFFAOYSA-N 288.351 3.282 70 20 CGID CC(C)C[C@H](NC[C@H]1CCCC[C@@H]1O)c1ccccn1 160466541 TZHUGHWLKYBVSG-PVAVHDDUSA-N 276.424 3.310 70 20 CGID CN(Cc1cccn1C)C(=O)Cc1c(F)cccc1Cl 160507888 AZQVHXFMZYOZED-UHFFFAOYSA-N 294.757 3.019 70 20 CGID C[C@H](NC(=O)N1CCC[C@@H](C)C1)c1ccsc1 160524584 SBXGHYSBUBAOQM-MNOVXSKESA-N 252.383 3.251 70 20 CGID CSc1cccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1 160704488 IZQGKGWDMOABBA-GFCCVEGCSA-N 294.420 3.488 70 20 CGID CCCC1(CNC(=O)[C@H]2CCOc3ccccc32)CC1 160734595 PMBTVQJAKOPNME-AWEZNQCLSA-N 273.376 3.249 70 20 CGID CCCN(Cc1ccccc1)C(=O)[C@H]1CCC(=O)C[C@@H]1C 159618703 OKKSIFOISPTULL-YOEHRIQHSA-N 287.403 3.431 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccnn1Cc1ccccc1 159844791 VPBNSEINBRJWPY-RHSMWYFYSA-N 283.375 3.306 70 20 CGID COc1ccc(N(C)C(=O)CC[C@@H]2CCCCO2)cc1F 159863822 GDBFLWIPEQJPAQ-ZDUSSCGKSA-N 295.354 3.146 70 20 CGID CCOc1cccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159493965 JSKLNQKMMYOZLF-IKGGRYGDSA-N 287.403 3.133 70 20 CGID COc1ccccc1[C@@H](C)CC(=O)OCc1cncs1 159568165 ULANRFAONCLBQU-NSHDSACASA-N 291.372 3.389 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCCOCC(C)C 159961868 BKSGQHJPZGFFQC-KGLIPLIRSA-N 295.448 3.339 70 20 CGID CC[C@@H](C)N(C)CCNCc1ccccc1OC(F)F 217382418 IAUHGYGMLMPTLN-GFCCVEGCSA-N 286.366 3.108 70 20 CGID NC(=O)c1ccc(NCc2coc3ccccc23)cc1 159793699 RBUVEKVRLZWALC-UHFFFAOYSA-N 266.300 3.144 70 20 CGID Cn1cc(Cl)cc1C(=O)NC1(c2ccccc2)CCC1 216912112 XKZLPAUNTDGACL-UHFFFAOYSA-N 288.778 3.488 70 20 CGID CC[C@H](N[C@@H]1CCC[C@@H](O)C1)c1ccc(OC)c(OC)c1 217619510 ZEVJTEFPKDFIMC-KFWWJZLASA-N 293.407 3.048 70 20 CGID CCc1ccccc1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 161039104 XTDCHRTVJJJOLL-HNNXBMFYSA-N 292.423 3.414 70 20 CGID CCC[C@H](CC1CCCC1)C(=O)N[C@H]1CCC[C@H](N)C1 161267533 NSQVCJOOVTUOOU-PMPSAXMXSA-N 280.456 3.369 70 20 CGID Cc1c(C(=O)N2CCC[C@H]2C2CCC2)cnn1CC(C)C 161367994 XOGXASSUNIZFOC-INIZCTEOSA-N 289.423 3.252 70 20 CGID CCN(Cc1nncn1C)[C@H](C)c1cc2ccccc2o1 160840159 CZXBYRYQJDNJNJ-GFCCVEGCSA-N 284.363 3.144 70 20 CGID C[C@@H](Nc1ccc2[nH]ccc2c1)C(=O)OC(C)(C)C 160915635 PTIDBBGUTLHNJW-SNVBAGLBSA-N 260.337 3.310 70 20 CGID C[C@H](CC(=O)Nc1cccc(F)c1)N[C@H]1CCCSC1 159518265 JKPFASMPMGFWKO-RISCZKNCSA-N 296.411 3.028 70 20 CGID C[C@H](N[C@@H]1CCOC(C)(C)C1)c1nc2ccccc2n1C 159934786 GRMKFTXSBIVWQK-QWHCGFSZSA-N 287.407 3.182 70 20 CGID O=C(Nc1ccc(Cl)cc1-n1cccc1)NC1CC1 159397196 UUOPRQCCWRRVGL-UHFFFAOYSA-N 275.739 3.415 70 20 CGID Cc1cccc(C(=O)N[C@H]2CCCc3sccc32)n1 159994311 LEEGJKMGFVRILN-LBPRGKRZSA-N 272.373 3.259 70 20 CGID C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCC1CC1 217987350 FXGZZLVHUAHRNN-DYVFJYSZSA-N 296.455 3.460 70 20 CGID CC[C@H](c1ccc(Br)cc1)S(=O)(=O)Cl 88251495 CLTIOWFXQWXRME-SECBINFHSA-N 297.601 3.469 70 20 CGID C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)C[C@@H]1C=CCC1 161245150 LMCLRFMXRUNUAH-CHWSQXEVSA-N 289.350 3.260 70 20 CGID CCc1nnc(COc2c(C)cccc2Cl)o1 160886050 ARJJRTXICSRIEL-UHFFFAOYSA-N 252.701 3.173 70 20 CGID CC(C)CONC(=O)Nc1cccc(COCC2CC2)c1 159604512 TUXRDWXOAWLOQE-UHFFFAOYSA-N 292.379 3.322 70 20 CGID CCc1ccc(CCC(=O)NCC2(C3CC3)CC2)cc1 159921526 WGOZRZAUYFPHBO-UHFFFAOYSA-N 271.404 3.488 70 20 CGID C[C@H]1CC(NC(=O)Nc2cccc(F)c2F)C[C@H](C)O1 159983926 UIOCDHJOXMZAGE-IUCAKERBSA-N 284.306 3.042 70 20 CGID CC(C)c1nc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cs1 159553467 ZNQKKUAJOGHBOM-MJBXVCDLSA-N 292.448 3.314 70 20 CGID COc1cc(N[C@H]2CCO[C@H](C(C)C)C2)ccc1F 160080192 ZHTBFFVMGYDWLL-JSGCOSHPSA-N 267.344 3.450 70 20 CGID CCCn1nccc1CN[C@H](C)Cc1ccc(C)s1 160153989 SDYBEPWSSPQYLA-GFCCVEGCSA-N 277.437 3.384 70 20 CGID CCN(CCCO)C(=O)c1cc2c(s1)CCCCCC2 160461928 CRRSNKYETDXQMQ-UHFFFAOYSA-N 295.448 3.252 70 20 CGID CC(C)[C@H](CCO)NC(=O)c1cc2ccccc2s1 160675191 MKECWRUZJFVLCO-LBPRGKRZSA-N 277.389 3.038 70 20 CGID C[C@@H](CN[C@H](C)C1CCOCC1)COCc1ccccc1 161315732 PHKNNEDZLWMLMS-JKSUJKDBSA-N 291.435 3.244 70 20 CGID CCCCN(C(=O)C1CCNCC1)[C@H](C)c1ccccc1 161355159 BKSMJMLDVFIYIK-OAHLLOKOSA-N 288.435 3.376 70 20 CGID CSC[C@H](C)C(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C 161485122 YGRAQPRJKPNMHA-QMMMGPOBSA-N 293.392 3.224 70 20 CGID CC[C@@H](NC(=O)C1CCCCC1)c1c(C)noc1C 160277606 HWYNANDDQVLELQ-CYBMUJFWSA-N 264.369 3.439 70 20 CGID CCCCc1ccc(CC(=O)N[C@@H](CCO)C(C)C)cc1 160474890 JOCKAJOWIYVTDT-KRWDZBQOSA-N 291.435 3.095 70 20 CGID Cc1cc(N[C@H]2CCO[C@@H](c3ccccc3)C2)ncn1 160531956 JGJSDDAMKOCRGS-LSDHHAIUSA-N 269.348 3.117 70 20 CGID Cc1ccsc1CCCC(=O)NCC(F)(F)F 160676413 PJCJUTOPOAFTFQ-UHFFFAOYSA-N 265.300 3.058 70 20 CGID CCCN(C)C(=O)NCC1(Cc2ccccc2)CC1 160720552 LYOJTHGLDYEBJY-UHFFFAOYSA-N 260.381 3.061 70 20 CGID CC[C@H](NC(=O)CC1(N)CCC1)C(C)(C)c1ccccc1 160763299 NATPMQXODOGDSN-HNNXBMFYSA-N 288.435 3.131 70 20 CGID Cc1conc1NC(=O)[C@H](C)Cc1ccc(Cl)cc1 160780537 UMXYLNFPUWCVDC-SECBINFHSA-N 278.739 3.454 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccn(-c2ccccc2)n1 160838537 MVASWRCLUPLMIV-CJNGLKHVSA-N 269.348 3.247 70 20 CGID C[C@@H](Sc1ccccc1)C(=O)N(C)Cc1cccn1C 160941442 YLJCYEAWUACPDD-CYBMUJFWSA-N 288.416 3.164 70 20 CGID CC(C)CCC(=O)NC[C@@H](C[C@H](C)O)c1ccccc1 159813883 SSOKRJDISVIERM-GOEBONIOSA-N 277.408 3.094 70 20 CGID Cc1ccc(NC(=O)c2ccccc2OCC2CC2)nc1 159838812 XULICXNJPNHVMA-UHFFFAOYSA-N 282.343 3.431 70 20 CGID O=C1[C@@H](Sc2ccncc2)CCCN1c1ccccc1 159938074 VTPKTDDIDATVGK-HNNXBMFYSA-N 284.384 3.369 70 20 CGID CCC[C@@H]1CN(C(=O)Nc2ccnc(C)c2Cl)CCO1 159769123 QXOIKKDNKLJTSB-LLVKDONJSA-N 297.786 3.076 70 20 CGID OCCNCc1ccccc1Oc1ccc(F)cc1Cl 159783881 AXHGNAOJIOLRPQ-UHFFFAOYSA-N 295.741 3.353 70 20 CGID CC[C@H](C)N(C)CCNCc1ccccc1OC(F)F 217382505 IAUHGYGMLMPTLN-LBPRGKRZSA-N 286.366 3.108 70 20 CGID CC1(C)C[C@@H]1C(=O)N[C@@H]1CCc2c(Cl)cccc21 160869044 UOCLCKYLIFJJRI-DGCLKSJQSA-N 263.768 3.490 70 20 CGID CON(C)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 218121761 LPGQSCALJYICHA-RKDXNWHRSA-N 274.147 3.117 70 20 CGID Cc1cccc(C(=O)N2CCOc3ccccc3C2)c1F 161483829 FFNHQFPCVQFERS-UHFFFAOYSA-N 285.318 3.169 70 20 CGID Cc1ccsc1C(=O)N1CCOc2cccc(F)c21 161502794 LXIQKHOBRUERAN-UHFFFAOYSA-N 277.320 3.235 70 20 CGID CCc1nn(C)c(Cl)c1C(=O)N1CC[C@@H](C)C[C@H](C)C1 160047233 OCKLLQRQNKEMTE-MNOVXSKESA-N 297.830 3.144 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cc(F)cc(Cl)c1O 160407019 XNDWWQSENSFXLM-YUMQZZPRSA-N 271.719 3.198 70 20 CGID COCCN(Cc1ccccc1)Cc1ccc(COC)cc1 160443725 QPDHFSRTAAHTHL-UHFFFAOYSA-N 299.414 3.482 70 20 CGID CCOC(=O)c1ccc(CN(C)Cc2ccccc2C)o1 160528453 DLUJWKSOCBSGQX-UHFFFAOYSA-N 287.359 3.397 70 20 CGID CCCC[C@H](CCC)NC(=O)c1cccc2[nH]c(=O)oc12 160940315 YRBFUGLRZRDCKD-NSHDSACASA-N 290.363 3.210 70 20 CGID Cc1nccc(NC(=O)N2CCSC(C)(C)C2)c1Cl 159654313 PUEFNZMDRCGRQY-UHFFFAOYSA-N 299.827 3.403 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCCOCC(C)C 159962130 BKSGQHJPZGFFQC-ZIAGYGMSSA-N 295.448 3.339 70 20 CGID CNC[C@H](C)C(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 159782003 HBDRCDHCJJYYAE-YQQAZPJKSA-N 288.435 3.150 70 20 CGID Fc1ccc2c(c1)[C@@H](N[C@H]1CCCSC1)CC2 159595962 QGPBOZWJPDDPJN-JSGCOSHPSA-N 251.370 3.298 70 20 CGID CCc1nc(CN[C@@H](CC)c2ccc(Cl)cc2)n[nH]1 160287091 OIPLHVOSCKYNGZ-LBPRGKRZSA-N 278.787 3.261 70 20 CGID O=C(NCC12CC3CC(CC(C3)C1)C2)Nc1ccccn1 217276310 SVGYQTUYAPXNMD-UHFFFAOYSA-N 285.391 3.420 70 20 CGID CCCN(Cc1noc(C2CCCCC2)n1)C1CC1 159836423 RLTCZRUBTXULAG-UHFFFAOYSA-N 263.385 3.492 70 20 CGID CCCCOC[C@H](CS(=O)(=O)Cl)C(C)(C)C 114478360 QTXMREFJNFICNF-SNVBAGLBSA-N 270.822 3.034 70 20 CGID CCc1ccccc1C(=O)Nc1cccc2cn[nH]c12 161101476 OCLQBSYNVZWFHU-UHFFFAOYSA-N 265.316 3.378 70 20 CGID CC(=O)NC1CCC(Nc2ccccc2Cl)CC1 161124440 WPVIRSOHMVNOKF-UHFFFAOYSA-N 266.772 3.199 70 20 CGID CC1=NN(c2ccc(C(=O)N3[C@@H](C)CC[C@H]3C)cc2)CC1 161477429 RCCQLUBXTIYHOI-OKILXGFUSA-N 285.391 3.286 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(C)nc2)cc1Cl 160219372 MFVFHEHLJHSFEU-UHFFFAOYSA-N 290.750 3.329 70 20 CGID Cc1cccc([C@H]2CCCN2C(=O)C[C@H]2CCCN2)c1C 160723419 RGETZEVAEQYHSL-NVXWUHKLSA-N 286.419 3.109 70 20 CGID CC1CCN(C(=O)N[C@H]2CCCc3cc(N)ccc32)CC1 159446126 RILMFGDHYZNNGB-INIZCTEOSA-N 287.407 3.088 70 20 CGID COc1ccc(N(C)C(=O)c2sc(C)nc2C)cc1F 159547048 RBNUPLNQAYNQEX-UHFFFAOYSA-N 294.351 3.184 70 20 CGID CN(CCSc1ccc(F)cc1)C[C@@H]1CCC[C@@H]1O 159746932 BQMCOUGTMOBRSY-WFASDCNBSA-N 283.412 3.011 70 20 CGID CC1(NC(=O)NCc2ccccc2Br)CCC1 160270718 JNCAFXXEPVZSIS-UHFFFAOYSA-N 297.196 3.191 70 20 CGID C[C@@H]1CCC[C@@H]1CC(=O)Nc1ccc(S(=O)(=O)F)cc1 864237654 BUFCLGUDPMGSPL-GHMZBOCLSA-N 299.367 3.110 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc2c(c1)OCO2 161271622 FHLZACXRBHXOMF-JSGCOSHPSA-N 289.375 3.456 70 20 CGID COc1cc(F)c(C(=O)N[C@H]2CCCC[C@@H]2C)cc1OC 161286700 BUPNIGWXLMYBKE-GWCFXTLKSA-N 295.354 3.151 70 20 CGID Cc1c(C(=O)N2CCC[C@@H]2C2CCC2)cnn1CC(C)C 161367874 XOGXASSUNIZFOC-MRXNPFEDSA-N 289.423 3.252 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)CCOC(C)C)c2C)o1 161387756 QQTBOALJPCNFAD-UHFFFAOYSA-N 291.351 3.040 70 20 CGID Cc1ccc(OCC(=O)N2[C@H](C)CC[C@H]2C)cc1C 161405812 GTRHCWZDNPLQCL-ZIAGYGMSSA-N 261.365 3.082 70 20 CGID CCO[C@@H](CC)C(=O)N[C@@H]1CCCc2sccc21 160145232 IFCHGPRHPFAXBN-NEPJUHHUSA-N 267.394 3.057 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@H]1CSCCS1 160421730 FXYNAXQOLLSZKQ-CMPLNLGQSA-N 299.486 3.090 70 20 CGID CC(C)(C)O[C@@H](C(=O)NCCCF)c1ccccc1 160457337 WQFLVMZARSYMAG-CYBMUJFWSA-N 267.344 3.019 70 20 CGID CCCN(CCC)C(=O)Nc1ccn(CC(F)(F)F)n1 160513316 WVNBVQZMSRINTI-UHFFFAOYSA-N 292.305 3.099 70 20 CGID CC(C)Cn1cc(NC(=O)C[C@H](C)c2ccncc2)cn1 160796915 CKTNWSKDNNJAAC-ZDUSSCGKSA-N 286.379 3.066 70 20 CGID CC(C)[C@H](NC(=O)[C@H]1CCCNC1)c1ccccc1Cl 160830748 YSVKFKOYRANXON-WFASDCNBSA-N 294.826 3.153 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)[C@H](C)CC1CCCCC1 160850377 YSLMWSRRCOCZJE-CHWSQXEVSA-N 283.412 3.051 70 20 CGID Fc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)c(F)c1 159616770 GZVXXRXIBPUTRW-SNPRPXQTSA-N 279.330 3.012 70 20 CGID O=C(CCCn1cccc1)Nc1ccc2c(c1)C(=O)CCC2 159818237 OQVVACAGEKMVOT-UHFFFAOYSA-N 296.370 3.426 70 20 CGID C[C@H](SCCN1CCOCC1)c1ncc(C(C)(C)C)o1 159848371 YHJQJLVLDULOAG-LBPRGKRZSA-N 298.452 3.099 70 20 CGID CCCCn1ncc(NC(=O)NC2(CC)CCC2)c1C 159655502 KEXDYRIYFCKKHM-UHFFFAOYSA-N 278.400 3.446 70 20 CGID CCOc1ccc([C@H](C)N[C@H](COC)C2CC2)cc1OC 159979041 CFSKSFKGYVVIQV-SWLSCSKDSA-N 293.407 3.170 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1ccc(OC)cc1C 159589168 OMHPYQBLVNJJEY-SWLSCSKDSA-N 261.365 3.312 70 20 CGID Cc1cccc(C(=O)N[C@@H]2CCNC3(CCC3)C2)c1Cl 160386501 KUZXNEVRVWLPOJ-GFCCVEGCSA-N 292.810 3.053 70 20 CGID CSCCCN1CCC[C@@H]1c1cccc(C)n1 159712639 FMQQSWGUVUWLRX-CQSZACIVSA-N 250.411 3.280 70 20 CGID CCN(CCN[C@@H](C)c1ccco1)C(=O)OC(C)(C)C 159485239 HBDJSFAKFJEYLR-LBPRGKRZSA-N 282.384 3.187 70 20 CGID CCOCCC1(CNC(=O)N2CCC[C@H](CC)C2)CC1 161485762 PKCNAJLAAXCAON-AWEZNQCLSA-N 282.428 3.025 70 20 CGID CC(C)Cc1ccc(CC(=O)NOCc2cccnc2)cc1 160721953 GWQADZUVSJZGHM-UHFFFAOYSA-N 298.386 3.071 70 20 CGID CC(C)C1CCN(C(=O)C[C@H](C)c2ccncc2)CC1 160729435 QKDCXFQAICALHA-AWEZNQCLSA-N 274.408 3.470 70 20 CGID CCS[C@@H]1CC[C@@H](N(C)Cc2cnc3ccccn23)C1 160879684 WHRSHVDZHDFYOC-UKRRQHHQSA-N 289.448 3.440 70 20 CGID CC(C)c1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cn1 160932321 WGJRQNZTKBNICU-STQMWFEESA-N 260.381 3.323 70 20 CGID CCCN1CCC(NC[C@H]2CCc3ccccc32)CC1 160955647 AMAULUVJJICCGM-MRXNPFEDSA-N 272.436 3.180 70 20 CGID CC[C@H](NC(=O)Nc1ccc(F)c(F)c1)[C@H]1CCCO1 159385650 HHEPKRUEJBLLGP-QWHCGFSZSA-N 284.306 3.044 70 20 CGID CC[C@@H](C)[C@H](C)NC(=O)CSc1nc2ccccc2[nH]1 159777933 UIXCSOJKAYVWRK-MNOVXSKESA-N 291.420 3.206 70 20 CGID COc1cc(NCc2cccc3c2OCCO3)ccc1F 159999823 WKVLVCMMPFGZJW-UHFFFAOYSA-N 289.306 3.218 70 20 CGID CCCOc1cccc(CNCCN(C)[C@@H](C)CC)c1 217397230 GLIWPXVZIIVNGD-HNNXBMFYSA-N 278.440 3.295 70 20 CGID CC(C)(C)C[C@H](CO)Nc1nc(C(F)(F)F)cs1 161439848 AHKYEJKMVULVKE-SSDOTTSWSA-N 282.331 3.371 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCC[C@H](C)C2)n1 161002915 AZTZSWJNTYWVRR-ZDUSSCGKSA-N 278.400 3.193 70 20 CGID C[C@@H](c1ccccc1Cl)N(C)C(=O)[C@@H]1CCCCO1 161119672 OXWHONRATXTWFU-FZMZJTMJSA-N 281.783 3.429 70 20 CGID Cc1cccc(C)c1CSCC(=O)NCC1CCC1 161385249 CYANFHABSIKJRT-UHFFFAOYSA-N 277.433 3.453 70 20 CGID Cc1cc(N[C@@H]2CCO[C@H](C3CC3)C2)nc(C(C)C)n1 160375400 VUYDZKHVYJHSLU-KGLIPLIRSA-N 275.396 3.278 70 20 CGID CC[C@@H](NC(=O)c1ccc(C)cc1)c1c(C)noc1C 160624283 UPDYCVVOGCGOPW-CQSZACIVSA-N 272.348 3.481 70 20 CGID CCSCC[C@H](C)NC(=O)C[C@H](C)c1ccncc1 160927171 KZSNYZHLXSZZCS-STQMWFEESA-N 280.437 3.223 70 20 CGID Fc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(F)c1 159616485 GZVXXRXIBPUTRW-QEJZJMRPSA-N 279.330 3.012 70 20 CGID O=C(CC1CCCC1)NCCOc1ccccc1Cl 159448956 BCYCGHRPBCXNIG-UHFFFAOYSA-N 281.783 3.415 70 20 CGID CSc1ccccc1NC(=O)N(C)[C@H]1CCSC1 159431713 ZGMZVBFJIUESKI-JTQLQIEISA-N 282.434 3.378 70 20 CGID CC1CCC(C)(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)CC1 159659117 PNNPEVDITUMUJT-JIDKMEAJSA-N 294.439 3.212 70 20 CGID Cc1ccsc1CCCC(=O)Nc1ccncc1 159922833 OYZHPQGRIRYMMF-UHFFFAOYSA-N 260.362 3.413 70 20 CGID Cc1ccc([C@H](C)NCCNC(=O)OC(C)(C)C)cc1C 218166645 CPDBSRMIIYKJEV-AWEZNQCLSA-N 292.423 3.479 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc2ccccc2[nH]1 159582199 RFASIZRSPDYMFH-DGCLKSJQSA-N 256.349 3.476 70 20 CGID CCC1(CC)CCN(C(=O)NCC(F)(F)F)CC1 160553032 JIDAFWQOSPCNNQ-UHFFFAOYSA-N 266.307 3.161 70 20 CGID CC(C)C[C@@H]1CCCN1CCCN1CCCCC1 160755561 JPBOISHRPIXFKU-INIZCTEOSA-N 252.446 3.373 70 20 CGID CN(CC1=CCCOC1)Cc1ccc(Br)cc1 160802218 VOZAYSGLQCVIDV-UHFFFAOYSA-N 296.208 3.228 70 20 CGID CC1CCC(N(C(=O)[C@@H]2CCCCO2)C2CC2)CC1 161027323 NIZRXGWPDCFOJG-PIMMBPRGSA-N 265.397 3.125 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)c2ccc(C)o2)n1 161292386 DHJUZGYUDXMFMT-UHFFFAOYSA-N 296.330 3.188 70 20 CGID Cc1nc(C)c(C(=O)N[C@H]2CCCc3sccc32)o1 160384320 QENAYTFTFJXZBH-NSHDSACASA-N 276.361 3.160 70 20 CGID CCCCOc1ccc(C(=O)N[C@H](CCO)C(C)C)cc1 160609648 FVXSXRJTCNHVAU-MRXNPFEDSA-N 293.407 3.002 70 20 CGID O=C(c1cc(F)cc(Cl)c1O)N1C[C@H]2CCC[C@@H]2C1 159422470 CJWONRMOUHAVAL-RKDXNWHRSA-N 283.730 3.057 70 20 CGID O=C(CCCc1ccccc1)NCC1(C2CC2)CC1 159699115 VTRAFJDCFYFLIC-UHFFFAOYSA-N 257.377 3.316 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccc(F)c(F)c1 217658295 XWSBBBUZGYGNSM-XZJROXQQSA-N 280.362 3.242 70 20 CGID CCCn1nccc1CN[C@H](C)c1ccc(C)cc1 160094766 AULGRGLOFXVWKW-CQSZACIVSA-N 257.381 3.452 70 20 CGID CCCn1nccc1CNc1cc2c(cc1Cl)OCO2 160024469 FLNAWKQAVGPGQL-UHFFFAOYSA-N 293.754 3.287 70 20 CGID Cc1nc(CN(C)Cc2csc(C3CC3)n2)cs1 161497972 YFTMGACDVOYPPM-UHFFFAOYSA-N 279.434 3.417 70 20 CGID CC[C@H](C(=O)NC[C@H](C)SC)c1ccc(F)cc1 161336410 MXFWRTXUIAKCGO-GWCFXTLKSA-N 269.385 3.187 70 20 CGID CC(C)(C)C[C@H](CO)Nc1nc(-c2ccccc2)ns1 161429810 GNDKHOIQBZTNAJ-GFCCVEGCSA-N 291.420 3.414 70 20 CGID CNC[C@@H](C)C(=O)N(C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 161455015 IXQVOHXRHZDMOZ-JHJVBQTASA-N 296.842 3.146 70 20 CGID CCOCCC1(CNC(=O)N2CCC[C@@H]2CC(C)C)CC1 161491658 CXOTVYDMPWFZJJ-OAHLLOKOSA-N 296.455 3.413 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)NCCC(C)C 160086659 ZZOQLGIKOXCRAX-LBPRGKRZSA-N 298.452 3.329 70 20 CGID COCc1cccc(NC(=O)N[C@@H](C)C2CCC2)c1 160578862 UXYHTZPHOYEKBU-NSHDSACASA-N 262.353 3.143 70 20 CGID CC[C@H](CC(=O)N[C@H](CCO)C(C)C)c1ccccc1 160634524 DYABTMUALUFCAL-GDBMZVCRSA-N 277.408 3.094 70 20 CGID O=C(NCC(F)(F)F)C1(Cc2ccccc2)CCC1 160895938 JBKUOKQATPDANQ-UHFFFAOYSA-N 271.282 3.078 70 20 CGID CCCOc1cccc(CC(=O)NC(C)(C)CC)c1 160937634 RDWBSRFCYKLPQS-UHFFFAOYSA-N 263.381 3.323 70 20 CGID CCN(CCCO)C(=O)c1sc2ccccc2c1Cl 160494754 GZOJUQGVNHVUBR-UHFFFAOYSA-N 297.807 3.399 70 20 CGID CCCCCNC(=O)NCCc1ccccc1Cl 217365923 VQUHZQVRTONRMI-UHFFFAOYSA-N 268.788 3.372 70 20 CGID Cc1cccc(CNC(=O)NCCc2ccccc2C)c1 217314573 KVAIBYBIZDMTGI-UHFFFAOYSA-N 282.387 3.345 70 20 CGID CCOCCCN1CCC[C@@H]1c1ccccc1OC 160424134 YSUXPNRGPXXYEB-OAHLLOKOSA-N 263.381 3.259 70 20 CGID CC[C@@H](S[C@H](C)C(N)=O)c1ccc(F)cc1F 161369080 BTUZDTSKULQFHR-RDDDGLTNSA-N 259.321 3.023 70 20 CGID CCCC(=O)NC[C@@H]1CCCN(CCC2CCCC2)C1 160220005 VYHUDTZGMQJHGM-INIZCTEOSA-N 280.456 3.195 70 20 CGID C[C@@H](CC(=O)N(CC(F)(F)F)C1CC1)c1ccncc1 160225767 OQDXVXKISFINPV-JTQLQIEISA-N 286.297 3.129 70 20 CGID COC(=O)c1cccc(NC(=O)C2CCC(F)(F)CC2)c1 160997157 IGCVQNPJESXPOW-UHFFFAOYSA-N 297.301 3.237 70 20 CGID Cc1ccccc1[C@H](O)CNc1nc(C(C)(C)C)ns1 159445684 HAFRPYXHXGRNAX-GFCCVEGCSA-N 291.420 3.290 70 20 CGID CCCCn1ncc(NC(=O)N(C)CC2CCC2)c1C 159676107 JGFZNAXIPFSWAX-UHFFFAOYSA-N 278.400 3.255 70 20 CGID CCC[C@H](C(=O)N[C@H](CCO)c1ccccc1)C(C)C 159516651 XRNSKETUQJAEQZ-JKSUJKDBSA-N 277.408 3.299 70 20 CGID CCOc1ccc([C@H](C)N[C@@H](COC)C(C)C)cc1OC 159970232 LKIGMUXSXJRFAQ-ZFWWWQNUSA-N 295.423 3.416 70 20 CGID Cc1cccc(N[C@@H]2CCCc3cc(N)ccc32)n1 159493762 MTCLGCCMWBPCEX-OAHLLOKOSA-N 253.349 3.462 70 20 CGID CSC[C@H]1CCCN1CCC(=O)c1ccc(C)cc1 160305174 FVFNKPBYDYYJQN-OAHLLOKOSA-N 277.433 3.395 70 20 CGID O=C(NCCc1cccc(F)c1)NC1CCCCCC1 217445548 HYFVTUSBGJXQCX-UHFFFAOYSA-N 278.371 3.390 70 20 CGID Cc1cccc(CCNC(=O)N[C@@H]2CCCC[C@H]2C)c1 217406589 ORMTVBCLYSPKSQ-GDBMZVCRSA-N 274.408 3.415 70 20 CGID Cn1ncc2c1CCC[C@@H]2NC[C@@H]1CCc2ccccc21 161005968 NCABOFDQVJZGCC-YOEHRIQHSA-N 281.403 3.117 70 20 CGID Cc1ccsc1CCCc1nc([C@H]2CCOC2)no1 161027176 KEPJQHJIMUDXQI-NSHDSACASA-N 278.377 3.119 70 20 CGID Cc1cccc(N(C)C(=O)c2ccnn2C(C)C)c1 161243120 QDBCOJTWVMFQSZ-UHFFFAOYSA-N 257.337 3.049 70 20 CGID CCc1ccc(CNC2(c3noc(C)n3)CCCC2)cc1 161370120 BJLRNIJYKCFJJN-UHFFFAOYSA-N 285.391 3.500 70 20 CGID CCOc1ccc2cc(C(=O)NCC3(C4CC4)CC3)[nH]c2c1 160041349 MKKXSFNBWYHVOW-UHFFFAOYSA-N 298.386 3.487 70 20 CGID Cc1cn(-c2ccccc2Cl)nc1C(=O)N(C)C1CC1 160086422 JALAKUSVJNIQNI-UHFFFAOYSA-N 289.766 3.069 70 20 CGID CCC(CC)C(=O)N[C@H]1CCc2c(OC)cccc21 160112334 DMDSHGFYOROSIV-AWEZNQCLSA-N 261.365 3.235 70 20 CGID CC(=O)Nc1cc(NC(=O)N[C@@H](C)C2CCC2)ccc1F 160314564 YZBAXHVSCWALBE-VIFPVBQESA-N 293.342 3.094 70 20 CGID O=C(c1ccccc1NCc1ccco1)N1CCCC1 160598942 SCBLEFVNPWJKKR-UHFFFAOYSA-N 270.332 3.128 70 20 CGID CCc1ccc(NC(=O)NCC(C)(C)[C@H](O)C(C)C)cc1 160843919 FZHYSNSDWARGJJ-OAHLLOKOSA-N 292.423 3.414 70 20 CGID Cc1cccc([C@@H](NC(=O)c2cc[nH]c2)c2ccccn2)c1 159887716 MLTKIHQBSMFQLF-QGZVFWFLSA-N 291.354 3.238 70 20 CGID CSCCCCC(=O)NCCO[C@@H]1CCCC[C@@H]1C 159947091 AEZIXVKERVMQEE-UONOGXRCSA-N 287.469 3.231 70 20 CGID CN(Cc1csc(-c2ccsc2)n1)[C@H](CN)C1CC1 160086672 ZATIQZSZUCGSGZ-CYBMUJFWSA-N 293.461 3.041 70 20 CGID CC(C)[C@H](NC1CCN(C2CCCC2)CC1)C1CC1 160506781 BNBDUJJZRZXFCM-KRWDZBQOSA-N 264.457 3.418 70 20 CGID O=S(=O)(Cl)C[C@H](F)c1c(F)cccc1Cl 1537958990 RUFKBISPNIVATG-ZETCQYMHSA-N 275.103 3.058 70 20 CGID Cc1c(C(=O)N[C@@H]2CCC[C@@H](N)C2)oc2c(C)cccc12 161063438 MSWIBFBJDRVHHY-CHWSQXEVSA-N 286.375 3.049 70 20 CGID Cc1nc(CC(=O)N2CCC[C@@H]3CCC[C@@H]32)c(C)s1 161324544 BTNXNPWGGBYZDW-JSGCOSHPSA-N 278.421 3.094 70 20 CGID C[C@H](NCC1(c2ccc(F)cc2)CC1)C1CCN(C)CC1 161380248 ORZDUTLYUYTZLN-AWEZNQCLSA-N 290.426 3.177 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)c2cc[nH]c2C)o1 161411125 ONCNRYNFRNTAJQ-AWEZNQCLSA-N 288.347 3.040 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@H](C)C[C@H]2CCCO2)c1 160010507 GDQFKXQXFRRANK-VNHYZAJKSA-N 293.407 3.312 70 20 CGID CC(C)Oc1ccc(CN[C@@H](C)c2cncc(F)c2)cn1 160087766 CJJLGYHVRAXNGS-LBPRGKRZSA-N 289.354 3.254 70 20 CGID CC/C(=C/C(=O)N(C)Cc1cnn(C)c1)c1ccc(C)cc1 160255985 PUJZSBSVNYDXTH-YBEGLDIGSA-N 297.402 3.181 70 20 CGID CCOc1cc(C)ccc1NC(=O)C[C@@H](C)SC 160380587 AUXKSXFLXOLTDD-LLVKDONJSA-N 267.394 3.474 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)N[C@@H]3C[C@@H]3C)c2C)c1 160743866 QCRHTKGZYQWZBN-GXTWGEPZSA-N 298.390 3.327 70 20 CGID c1ccn2c(CN3CCC[C@H]4CCC[C@@H]43)cnc2c1 160789764 DNNSBZOSINGDGH-HIFRSBDPSA-N 255.365 3.099 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccccc1F 160956449 IXFBREGCMNDGIW-JTQLQIEISA-N 291.347 3.279 70 20 CGID C[C@H](N)C(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 160981764 PPAXEHUQKMYAGL-SMDDNHRTSA-N 280.799 3.131 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@H]1c1cccc(F)c1F 159862547 YURAXBQQPYYTMP-QWHCGFSZSA-N 291.341 3.375 70 20 CGID C[C@H](CC(=O)N1CCC[C@H]1C1CCC1)c1ccncc1 159950776 RDZKMEBGPYSYOG-CJNGLKHVSA-N 272.392 3.366 70 20 CGID CC(C)Oc1cccc(CC(=O)NCC2(C3CC3)CC2)c1 159960480 DIFSNKASTDVJOU-UHFFFAOYSA-N 287.403 3.323 70 20 CGID COc1cccc([C@@H](O)CN[C@H](C)c2cccs2)c1 160723564 QXCGMAMTNKRDII-RISCZKNCSA-N 277.389 3.141 70 20 CGID CCc1cc(O)nc(CN2CCC[C@@H]2c2ccsc2)n1 160855154 PHDOWHIIZDSNBB-CYBMUJFWSA-N 289.404 3.143 70 20 CGID CC(C)CC[C@H](C)NC(=O)NCCc1ccccc1F 218052160 IPKBSBZWQWQUPY-ZDUSSCGKSA-N 280.387 3.492 70 20 CGID CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1NC(=O)c1ccc(CN)cc1 217822469 MLYHGVAPQYBZBT-COXVUDFISA-N 288.435 3.336 70 20 CGID Cc1cnc(NC[C@@](C)(O)c2ccccc2Cl)nc1C 160180484 ZUDZSQJEBADJIM-OAHLLOKOSA-N 291.782 3.066 70 20 CGID Cc1c(C(=O)N(CC(C)C)C2CC2)cnn1CC(C)C 160619848 KWQZUIQRWKBXFN-UHFFFAOYSA-N 277.412 3.108 70 20 CGID CCOC(=O)c1ccc(CN(C)Cc2ccccc2F)o1 160731854 GXNNQRXLSZVNQO-UHFFFAOYSA-N 291.322 3.227 70 20 CGID COc1cccc([C@@H](C)CC(=O)Nc2cccc(F)n2)c1 160846683 SCQKYDOUMLWVMZ-NSHDSACASA-N 288.322 3.362 70 20 CGID CCc1ccc(NC(=O)N[C@@H](CC)[C@H]2CCCO2)cc1 159409963 VHIJLEWGQVLHOS-LSDHHAIUSA-N 276.380 3.328 70 20 CGID Cc1nccc(NC(=O)N2CCC3(CCC3)C2)c1Cl 159929250 VHSZCIPTJGSLOY-UHFFFAOYSA-N 279.771 3.451 70 20 CGID CCc1noc(C)c1CNc1ccc(N2CCCC2=O)cc1 159364519 HQHBZGPPWDLHMI-UHFFFAOYSA-N 299.374 3.284 70 20 CGID Cc1ccc(C)c(C(=O)OCCCc2ccncc2)c1 218315344 SRKPBYCFZBTRRZ-UHFFFAOYSA-N 269.344 3.488 70 20 CGID COC(=O)[C@@H](C)CSCc1noc(C2CCCCC2)n1 159815509 UEYCNLNBIJGXOD-JTQLQIEISA-N 298.408 3.160 70 20 CGID CN(Cc1csnn1)Cc1cccc(Cl)c1Cl 160751578 HFDDBPZRSUHZQU-UHFFFAOYSA-N 288.203 3.477 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1c(C)noc1C 161027319 LXTOIONPKGHFMQ-UKRRQHHQSA-N 278.396 3.261 70 20 CGID CCOCCCC(=O)N(C)[C@@H]1CCCC[C@H]1CC 161298136 KLLQIHKBBOQZAQ-ZIAGYGMSSA-N 255.402 3.230 70 20 CGID CC[C@@H](Nc1nc(C(C)(C)C)ns1)[C@H]1CCCO1 160118049 XPHBYPDVLRYOGG-NXEZZACHSA-N 269.414 3.205 70 20 CGID Cc1nc2ccc(NC(=O)N[C@H](C)C3CCC3)cc2o1 160364164 MXYLLTOQAPHMFN-SECBINFHSA-N 273.336 3.446 70 20 CGID CCOCCCN1CCC[C@H]1c1cccc2c1OCCO2 160399823 IPEGTLYPABJPBT-HNNXBMFYSA-N 291.391 3.021 70 20 CGID CC[C@H](NC(=O)[C@H]1CCCCO1)c1ccc(Cl)cc1 160502743 MBMZUIFERIJSKD-UONOGXRCSA-N 281.783 3.476 70 20 CGID COCC(C)(C)C(=O)N[C@@H]1CC(C)(C)c2ccccc21 160562855 JTTDLBOBPJFOEV-CQSZACIVSA-N 275.392 3.198 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCOC(C)(C)C2)c(C)c1 160665952 WIGAGWDVDPDSJW-ZDUSSCGKSA-N 276.380 3.383 70 20 CGID CC(C)Cn1ccnc1CNc1nc(C(C)(C)C)ns1 159632226 URSGFAKTQDCQNM-UHFFFAOYSA-N 293.440 3.300 70 20 CGID COc1ccc(N(C)C(=O)CC(C)(C)C)cc1F 159673180 PESAGHLAKWVQMO-UHFFFAOYSA-N 253.317 3.233 70 20 CGID CC(C)(CNC(=O)CCCCCCN)c1cccc(F)c1 159703724 RSEAYVGHPGWPHN-UHFFFAOYSA-N 294.414 3.129 70 20 CGID COc1cc(NCc2nc3ccccc3n2C)ccc1F 159934095 IPFZIIAYNRJFPY-UHFFFAOYSA-N 285.322 3.333 70 20 CGID C[C@H]1CN(Cc2ccc(C(C)(C)C)cc2)CC[C@@H]1O 159456423 DHFSJQIXIRMVNH-BBRMVZONSA-N 261.409 3.187 70 20 CGID CSC[C@@H]1CCCN1C(=O)c1ccc(F)cc1C 159417723 FEZBVBUMIZQZGX-LBPRGKRZSA-N 267.369 3.102 70 20 CGID CCc1ncc(NC(=O)N(C)[C@H]2CCCC[C@H]2CC)cn1 161137855 LEHXOTDEWACCNI-OCCSQVGLSA-N 290.411 3.472 70 20 CGID C[C@H](NCC1(CO)CCCC1)c1cccc(OC(F)F)c1 160094074 JOAOKQKVNMCXRT-LBPRGKRZSA-N 299.361 3.491 70 20 CGID CCCC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 160155505 YVGNGOPLRVIIHG-QGZVFWFLSA-N 268.360 3.396 70 20 CGID CC[C@@H](NC(=O)c1ccsc1)c1c(C)noc1C 160164447 AXXAITNWUMOITH-LLVKDONJSA-N 264.350 3.234 70 20 CGID FC(F)(F)c1ccnc(N[C@H]2CCO[C@@H](C3CC3)C2)c1 160332798 AISKDABCEULTFS-NWDGAFQWSA-N 286.297 3.470 70 20 CGID CC[C@]1(C)CCCN(C(=O)N[C@H]2CCO[C@H](C3CC3)C2)C1 160389497 DKDSJVSULRCRFO-YQQAZPJKSA-N 294.439 3.166 70 20 CGID CCCC1(CNC(=O)c2cccc(-c3n[nH]c(C)n3)c2)CC1 160727785 HROCPKKTNNUAOP-UHFFFAOYSA-N 298.390 3.090 70 20 CGID FC(F)CN1CCC(NC[C@H]2CCc3ccccc32)CC1 160976510 LNSKRKVZPXKNIM-CQSZACIVSA-N 294.389 3.036 70 20 CGID CC[C@H](Nc1nc(C(C)(C)C)ns1)c1noc(C)n1 159800548 XNFJSPPHQWYYIP-QMMMGPOBSA-N 281.385 3.090 70 20 CGID Cc1ccc(C(=O)CCC(=O)NCC2(C3CC3)CC2)s1 159817886 MVZJJUKHXCGTAL-UHFFFAOYSA-N 291.416 3.326 70 20 CGID CCOc1cccc(NC(=O)NC2C[C@@H](C)O[C@H](C)C2)c1 159635891 DOMSQTBSBWDDHH-VXGBXAGGSA-N 292.379 3.163 70 20 CGID COc1ccc2c(c1)C[C@@H](N[C@H]1CCCSC1)CC2 159567340 OWCZFDXOQTVKDJ-GJZGRUSLSA-N 277.433 3.038 70 20 CGID CN(Cc1cc2ccccc2nc1Cl)[C@H](CN)C1CC1 160099446 JCTNBNCVJXVLEZ-OAHLLOKOSA-N 289.810 3.057 70 20 CGID CC(C)(C)CC(=O)NC[C@H]1CCCN1c1ccccc1 217806526 LOMJNPYAOZRSKS-OAHLLOKOSA-N 274.408 3.208 70 20 CGID Cc1cccc(C)c1OCCCNC(=O)NCCC(C)C 217298326 BAJNOBIZHZTVHG-UHFFFAOYSA-N 292.423 3.418 70 20 CGID CCCn1c(C)nnc1COc1ccc(F)cc1Cl 161189129 AGIRDYSQUVOJEV-UHFFFAOYSA-N 283.734 3.368 70 20 CGID CC[C@H](C)OCC(=O)Nc1cc(Cl)c(N)c(Cl)c1 160174828 HYCZQDDFOLCRIU-ZETCQYMHSA-N 291.178 3.329 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(C2CC2)nc(C)n1 160274930 PFKKXVWAJHWUJH-IAQYHMDHSA-N 259.353 3.037 70 20 CGID COCCOc1ccc(NC(=O)C[C@@H](C)SC)c(C)c1 160371985 VHWDSPNWEZXCIX-GFCCVEGCSA-N 297.420 3.100 70 20 CGID Cc1nc2ccccn2c1CN1CCCC[C@H]1c1cn[nH]c1 160408558 DSDYUBKSXXZUMG-HNNXBMFYSA-N 295.390 3.093 70 20 CGID CC(C)Sc1ccccc1NC(=O)c1cnn(C)c1 160909406 ABCYAOSPTWSKNT-UHFFFAOYSA-N 275.377 3.173 70 20 CGID CC(C)c1ccc(C2(CNC(=O)[C@@H](C)N)CCCC2)cc1 159473308 UQZZIGVBRFZOBA-CQSZACIVSA-N 288.435 3.085 70 20 CGID CC(=O)Nc1ccccc1OCc1ccc(Cl)cn1 159521353 IFGVKJSQKLIBFH-UHFFFAOYSA-N 276.723 3.272 70 20 CGID CCC[C@H]1CN(C(=O)N[C@H](C)c2ccc(C)cc2)CCO1 159952242 UYGMAGIXODDUMS-ZBFHGGJFSA-N 290.407 3.267 70 20 CGID C[C@H](NC(=O)N(C)CC1CCOCC1)C1CCCCC1 159378417 JTQNITGRMZFQCK-ZDUSSCGKSA-N 282.428 3.023 70 20 CGID Cc1ccc(CN[C@H]2CCSC2)cc1Br 218118376 QTKVWQMDZLFENA-NSHDSACASA-N 286.238 3.353 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCc2ccc(OC)cc21 160081486 JQTRLPFRENKPSM-CXAGYDPISA-N 276.424 3.002 70 20 CGID Cc1noc(C)c1CNc1nnc(C(C)(C)C)s1 160474617 LZBJQIWRPRHQAY-UHFFFAOYSA-N 266.370 3.053 70 20 CGID c1ccc(NCCc2nc([C@@H]3CCCS3)no2)cc1 160625674 MSCDJLWSVUQQHW-LBPRGKRZSA-N 275.377 3.292 70 20 CGID C[C@@H]1CCC[C@H](CNC(=O)N2CCC[C@@H](C)C2)C1 218051008 DWAOAXXMUZAWIR-MCIONIFRSA-N 252.402 3.254 70 20 CGID COc1ccc([C@H](C)N(C)CC[C@@H]2CCCN2C)cc1 161354037 PMJDHARPNLZKLB-HOCLYGCPSA-N 276.424 3.172 70 20 CGID C[C@@H](c1cccc2ccccc12)S(=O)(=O)Cl 106524820 SXNOAQWOJVAUJC-VIFPVBQESA-N 254.738 3.469 70 20 CGID COC[C@@H](N[C@@H]1CCOc2c(Cl)cccc21)C1CC1 161293162 YIKFNCQHBLIJKL-ZIAGYGMSSA-N 281.783 3.178 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCCc1nc2ccccc2s1 160146617 LVJCTSCIXARCHD-MEDUHNTESA-N 288.416 3.391 70 20 CGID CCC(CC)CNC(=O)N1CCC[C@@H]1CN1CCCCC1 160575509 GNIJVZQINYXWJH-MRXNPFEDSA-N 295.471 3.083 70 20 CGID CCCN(CC(=O)Nc1ccccc1C)Cc1ccn(C)c1 160738179 FPASGPSIOXMTOT-UHFFFAOYSA-N 299.418 3.184 70 20 CGID CC[C@H](NC(=O)C[C@@H](C)SC)c1c(C)noc1C 160781978 VUXUZDRUWYSTEN-KCJUWKMLSA-N 270.398 3.000 70 20 CGID C[C@H]1CCCN(C[C@@H](O)c2cc3ccccc3o2)C1 216879705 BQXRUMHZFNYRQK-GXTWGEPZSA-N 259.349 3.198 70 20 CGID CC(C)n1cc(CNc2cc3c(cc2Cl)OCO3)cn1 218128067 PRRMVPBBUXNTGJ-UHFFFAOYSA-N 293.754 3.458 70 20 CGID Cc1nn(C)cc1CNC[C@H](c1ccccc1)C(C)C 159851443 WDUXNOMYMGJTHU-KRWDZBQOSA-N 271.408 3.258 70 20 CGID CCOc1ccc(CN[C@@H]2CCOC(C)(C)C2)cc1 160443098 AHOVRNWTPCHUQI-CQSZACIVSA-N 263.381 3.133 70 20 CGID CN1CCN(Cc2cccc(F)c2)[C@@H](c2ccccc2)C1 216734744 HBURQRYLCXQUQH-GOSISDBHSA-N 284.378 3.314 70 20 CGID C[C@@H](NCCc1ccc2c(c1)OCO2)c1cccs1 161125474 VHNUHZJNVAVXKT-LLVKDONJSA-N 275.373 3.370 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)NC2CCN(C(C)(C)C)CC2)C1 161201091 UCYQJILLRKJGOT-ZIAGYGMSSA-N 280.456 3.192 70 20 CGID CCc1c(-c2nc(-c3ccccn3)no2)cnn1CC(C)C 161401936 QEQPJRMVTVKIDE-UHFFFAOYSA-N 297.362 3.214 70 20 CGID COc1ccc(OCCCC(=O)N2[C@@H](C)CC[C@@H]2C)cc1 161442023 NUQWKVVKUDNSRP-KBPBESRZSA-N 291.391 3.254 70 20 CGID CCn1cc(NC(=O)[C@H]2C[C@@H]2c2sccc2C)cn1 161447313 GKELPJCNYROMRI-RYUDHWBXSA-N 275.377 3.015 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)COc1ccc(F)c(Cl)c1 161460316 QSDIRKYPKYULBO-NXEZZACHSA-N 285.746 3.257 70 20 CGID CS[C@H](C)CC(=O)Nc1cccc(Cl)c1N(C)C 160001390 UQRKCDRPZDJJPN-SECBINFHSA-N 286.828 3.486 70 20 CGID CCCc1nnc(NC(=O)c2ccc(C(C)C)nc2)s1 160037740 IAWFEMOYZGUMRG-UHFFFAOYSA-N 290.392 3.261 70 20 CGID Cc1cc(N[C@H]2CCO[C@H](C3CC3)C2)nc(C(C)C)n1 160375544 VUYDZKHVYJHSLU-KBPBESRZSA-N 275.396 3.278 70 20 CGID CCOCCCN1CCC[C@@H]1c1cccc2c1OCCO2 160399695 IPEGTLYPABJPBT-OAHLLOKOSA-N 291.391 3.021 70 20 CGID CC1(C)C[C@H](NCc2ccc(F)c3cccnc23)CCO1 160531877 VKZJZKFNDJQTDV-CYBMUJFWSA-N 288.366 3.421 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)c1nnnn1-c1ccccc1 160575580 JWZJAHJVXUFHQX-KGLIPLIRSA-N 287.411 3.091 70 20 CGID CCO[C@@H]1C[C@H](N(C)C(=O)NCCC(C)C)C12CCC2 160645309 PQVDPHFHMNNEAB-UONOGXRCSA-N 282.428 3.022 70 20 CGID Cc1ccc(NC(=O)NCC(C)(C)[C@H](O)C(C)C)cc1C 160671938 RSTQVCMDQNWCSX-OAHLLOKOSA-N 292.423 3.468 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)NCC1(c2ccccc2)CCC1 159412507 RIMQZTPMUWPELB-YOEHRIQHSA-N 299.414 3.230 70 20 CGID C[C@](O)(CN[C@@H]1CCc2cc(F)ccc21)c1ccsc1 159871837 HVZAXYVJBWLNFH-CVEARBPZSA-N 291.391 3.372 70 20 CGID Fc1cccc(Cl)c1CSCCN1CCOCC1 159928407 UVSHYMGWQZSBKB-UHFFFAOYSA-N 289.803 3.045 70 20 CGID CC[C@H](C(=O)NCc1c(C)noc1C)c1ccc(F)cc1 159363747 YTYSCRWQAGPTQH-AWEZNQCLSA-N 290.338 3.241 70 20 CGID COc1cc(CN[C@H]2C[C@H]3CC[C@@]2(C)C3(C)C)ccn1 218494541 XNMZQORWTCGKQF-JKIFEVAISA-N 274.408 3.395 70 20 CGID CC(C)C[C@@H](CN)NC(=O)c1cc2ccc(F)cc2s1 161204367 NKYCUDBBVMDXBS-LBPRGKRZSA-N 294.395 3.144 70 20 CGID O=C([C@@H]1CCCCO1)N(Cc1ccc(F)cc1F)C1CC1 161017801 OLODZTQUSZQKQJ-HNNXBMFYSA-N 295.329 3.025 70 20 CGID CCC1(CNC(=O)N[C@@H](C)CSC)CCCC1 161073881 DDGWJEWUWQEKAM-NSHDSACASA-N 258.431 3.008 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)NCCCC1CCCCC1 160012117 KUPAZFWGBUELCK-BBRMVZONSA-N 279.424 3.468 70 20 CGID COC(=O)c1csc(NC(=O)NC2(C)CCCCC2)c1 160889915 UUWWQTYXGGQYGT-UHFFFAOYSA-N 296.392 3.379 70 20 CGID CCN(C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)C1CC1 160926897 FCFYNIZZFJEIHS-ZBFHGGJFSA-N 288.391 3.101 70 20 CGID CC[C@H](c1ccccc1)N(CC(=O)OC)Cc1ccccn1 159671392 BGXQIDBAWYXVSV-QGZVFWFLSA-N 298.386 3.208 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c(F)c1 159361407 DCPAQQJAWJNUNG-CYBMUJFWSA-N 291.366 3.356 70 20 CGID C[C@H]1Cc2ccc(F)cc2[C@H]1NCCOCC(F)(F)F 159377143 DXPCVFWZIMOAOI-ZANVPECISA-N 291.288 3.228 70 20 CGID Cc1csc(CCNCc2cccc3cc[nH]c23)n1 218103751 UWCIKTIRLDJUTH-UHFFFAOYSA-N 271.389 3.265 70 20 CGID CCO[C@@H]1C[C@@H](NCc2cccc(F)c2F)C1(C)C 217901519 GODVSDLYNRIAQT-CHWSQXEVSA-N 269.335 3.258 70 20 CGID CCCCCOCC[C@@H](C)CCS(=O)(=O)Cl 115235218 YHZMZMPFANXFNB-LLVKDONJSA-N 270.822 3.178 70 20 CGID CC[C@H](N[C@@H](C)c1nnc(C)o1)c1ccc(F)cc1F 161002042 OARDBOKMIDSOEQ-SDBXPKJASA-N 281.306 3.458 70 20 CGID CN(C)c1ccnc(N[C@@H]2CCCc3sccc32)n1 161069320 GWMNIWQSOASYRB-LLVKDONJSA-N 274.393 3.094 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CCC(C)(C)c1ccccc1 161226064 ZDNDTXPOGLMGRF-INIZCTEOSA-N 291.435 3.268 70 20 CGID CC(C)c1ccc(OCCNC(=O)c2ccccc2N)cc1 161475033 UZWKLABWBPUEKC-UHFFFAOYSA-N 298.386 3.201 70 20 CGID C[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C[C@@H]1C 160006729 GTZMWRQEDWUEMA-ZJUUUORDSA-N 267.760 3.245 70 20 CGID C[C@H]1CCCC[C@@H]1OCCNC(=O)N1CCC2(CCC2)C1 160426339 QHLRBVXUKAHQHY-GJZGRUSLSA-N 294.439 3.167 70 20 CGID CC[C@H](C)[C@H](C)NC(=O)Nc1ccn(CC(F)(F)F)n1 160571212 PNIYUDYGXLNXRW-IUCAKERBSA-N 292.305 3.002 70 20 CGID Cc1ccc(-c2n[nH]cc2CN[C@@H]2CCOC(C)(C)C2)o1 160646954 VPCJSXQAFJSQDD-CYBMUJFWSA-N 289.379 3.025 70 20 CGID CC(C)(C)SCCCC(=O)NCCc1cccc(O)c1 160722730 FSBFIWWUNIXYHZ-UHFFFAOYSA-N 295.448 3.363 70 20 CGID CC(C)NCCC(=O)Nc1ccccc1OC(C)(C)C 160945397 KMEMOZJVYMUKOV-UHFFFAOYSA-N 278.396 3.191 70 20 CGID COc1ccccc1-c1noc([C@@H]2CCC(=O)C[C@@H]2C)n1 160990882 NOWJSKQLILVKET-CMPLNLGQSA-N 286.331 3.218 70 20 CGID O=C(Nc1cc(F)ccc1OC(F)F)C1CC=CC1 159415042 SXBDPTIRWOLPSL-UHFFFAOYSA-N 271.238 3.332 70 20 CGID Cc1cc(Cl)ccc1NC(=O)N[C@H]1CC[C@H](O)CC1 159821223 SFTFXHGBEMWLTM-TXEJJXNPSA-N 282.771 3.073 70 20 CGID O=C(Nc1cc(F)ccc1O)c1ccn(C2CCCC2)n1 159875528 NWPBYOCOFBOXCI-UHFFFAOYSA-N 289.310 3.095 70 20 CGID CCOc1ccc(CNC(=O)Nc2ncccc2C)cc1 217301016 COIYXQMYHHSROO-UHFFFAOYSA-N 285.347 3.110 70 20 CGID O=S(=O)(Cl)C[C@H](F)c1ccc(F)cc1Cl 1537958816 MXPVISACEQXOJB-QMMMGPOBSA-N 275.103 3.058 70 20 CGID CCC1(CNc2ccc(C(F)(F)F)nn2)CCC1 218061029 XOVTXNUUTHRDMO-UHFFFAOYSA-N 259.275 3.488 70 20 CGID CCC(C)(CC)C(=O)Nc1ccc(S(=O)(=O)F)cc1 776368503 WWMXFVDKIOXHBH-UHFFFAOYSA-N 287.356 3.110 70 20 CGID CC[C@H](N[C@@H](C)C(=O)NCC(C)C)c1ccc(F)cc1F 161014560 CIDJTGXCMYSNEN-NHYWBVRUSA-N 298.377 3.166 70 20 CGID CCCc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1 160421752 HLWCDFBZXVHGLH-CXAGYDPISA-N 298.434 3.205 70 20 CGID COc1cccc(CCCN2CCC(NC(C)C)CC2)c1 160496821 FGFYLRALFMHYSU-UHFFFAOYSA-N 290.451 3.090 70 20 CGID Cc1cccc2c1CC[C@@H]2NC(=O)NC1(C)CCC1 160840443 VACDDBNDTDNAAK-AWEZNQCLSA-N 258.365 3.224 70 20 CGID CC[C@H](NCC1CCN(C(C)=O)CC1)c1ccc(F)cc1 160891257 YPKLQXHHWGTKTQ-KRWDZBQOSA-N 292.398 3.125 70 20 CGID CCCn1ccc2ccc(NC(=O)[C@@H]3CC[C@@H](N)C3)cc21 159851535 SUDUIBRIYWTBPN-ZIAGYGMSSA-N 285.391 3.117 70 20 CGID CC[C@@H](CC(=O)NCC1(N)CCCCC1)c1ccccc1 159721359 CVVZNOYXBGTPTN-HNNXBMFYSA-N 288.435 3.348 70 20 CGID CC[C@@H](NC(=O)[C@@H]1CCC[C@H](N)C1)c1ccc(F)cc1F 159727262 AYVLEHFBMSYGIZ-IFUGULHKSA-N 296.361 3.050 70 20 CGID CC1(C)C[C@@H](NC[C@@H]2CCOc3ccccc32)CCO1 159776520 BCXIPPBHZDONRE-KBPBESRZSA-N 275.392 3.100 70 20 CGID CN(C)[C@@H](CNCc1ccc(Cl)cc1F)c1ccco1 160658539 VATJBBUBVFDUNU-AWEZNQCLSA-N 296.773 3.465 70 20 CGID CCc1ncnc(N[C@@H](C)Cc2ccsc2)c1F 217985506 IBHYXRRUBWKFGM-VIFPVBQESA-N 265.357 3.283 70 20 CGID c1ccc2c(CN3CCC([C@H]4CCCN4)CC3)coc2c1 161112370 RUUGNRQRHRFWAY-QGZVFWFLSA-N 284.403 3.397 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)c2ccoc2C)o1 161246941 HZTPBKHHZBYGLC-AWEZNQCLSA-N 289.331 3.305 70 20 CGID CSC[C@@H]1CCCN1c1nc(C(C)(C)C)ns1 160014052 GNIVSUIWXQDVDP-VIFPVBQESA-N 271.455 3.167 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCCSc1ccccc1 160121676 IDXNNSYOLQWVLS-UKRRQHHQSA-N 263.406 3.331 70 20 CGID Cc1nnc(NC(=O)CC2CCC(C)(C)CC2)s1 160165766 ZOSQSFXRDSKQPB-UHFFFAOYSA-N 267.398 3.392 70 20 CGID CNC(=O)c1ccc(NC(=O)c2ccsc2)c(Cl)c1 160289154 ODLWZXZXSJZASJ-UHFFFAOYSA-N 294.763 3.013 70 20 CGID CCCCc1ccc(CC(=O)N[C@H](CCO)C(C)C)cc1 160475004 JOCKAJOWIYVTDT-QGZVFWFLSA-N 291.435 3.095 70 20 CGID CC[C@@H](NC(=O)C[C@H](C)SC)c1c(C)noc1C 160782369 VUXUZDRUWYSTEN-GZMMTYOYSA-N 270.398 3.000 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)OCc1cccnc1 159409570 KLOOOHORKINUAM-QWHCGFSZSA-N 273.357 3.298 70 20 CGID CCc1ccc(/C=C/C(=O)N(CC)c2ccncc2)o1 159973249 QXAAZBRJVVQOMS-BQYQJAHWSA-N 270.332 3.303 70 20 CGID C[C@H](NC(=O)c1cccc2[nH]cnc12)[C@@H](C)c1ccccc1 159787751 DLLYDDFWZBCIIM-OLZOCXBDSA-N 293.370 3.485 70 20 CGID O=C(C1=CCCC1)N(Cc1ccccc1F)C1CC1 159795945 IDNGVEMZDFWCIB-UHFFFAOYSA-N 259.324 3.427 70 20 CGID Cc1noc(C)c1CNCc1cccc2cc[nH]c12 218138113 DONIZKPNEPIYCL-UHFFFAOYSA-N 255.321 3.063 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCc2cc(F)ccc21 160060229 RFHPJYWLPZOFDA-BLLLJJGKSA-N 264.388 3.133 70 20 CGID CC(C)[C@@H](CCO)NC(=O)c1cc2c(s1)CC[C@@H](C)C2 160746940 OMRCYZMQRVEKRW-DGCLKSJQSA-N 295.448 3.010 70 20 CGID O=C(NCc1ccncc1)Nc1c(F)cccc1Cl 217313138 MNFRFRBYBGIMBO-UHFFFAOYSA-N 279.702 3.196 70 20 CGID CCCC[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)C(=O)OC(C)(C)C 161197168 AQSUSQQVXHQBBN-RDBSUJKOSA-N 295.423 3.049 70 20 CGID CC[C@H](C)OCC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 160022812 USCCYIRAGPNTQH-MJBXVCDLSA-N 263.381 3.110 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccccn1 160374318 ZVYWWJWVJXMSIY-MNOVXSKESA-N 258.346 3.194 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccccn1 160374720 ZVYWWJWVJXMSIY-WDEREUQCSA-N 258.346 3.194 70 20 CGID CCc1nc(Cl)c(C)c(N[C@@H]2CCO[C@@H](C3CC3)C2)n1 160469467 WOQUYEQEKJYTSA-VXGBXAGGSA-N 295.814 3.370 70 20 CGID CCN(C)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 160500642 IAGQTTAYPZTOSD-CABCVRRESA-N 260.381 3.059 70 20 CGID Cc1cc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)ncn1 160531859 JGJSDDAMKOCRGS-HUUCEWRRSA-N 269.348 3.117 70 20 CGID CC[C@@H](NC(=O)c1ccccc1)c1c(C)noc1C 160623768 QKWJYONOXOXIHE-CYBMUJFWSA-N 258.321 3.173 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cc(C)on1 160876248 WRSGILJEIPXSDU-YPMHNXCESA-N 250.342 3.024 70 20 CGID CCC1CCN(C(=O)c2ccc(N(C)C)cc2F)CC1 159835413 HIWITTXLFYOXMU-UHFFFAOYSA-N 278.371 3.154 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cnn(C(C)(C)C)c1C 159643947 VCKIVHOYGBTHJE-TZMCWYRMSA-N 277.412 3.255 70 20 CGID Cc1[nH]c2ccccc2c1CC(=O)NCC1(C2CC2)CC1 159668834 DLCHAGSKVVIOJZ-UHFFFAOYSA-N 282.387 3.325 70 20 CGID O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCCS1 159932799 OQQZWNCGTWTXEW-VHSXEESVSA-N 291.294 3.124 70 20 CGID C[C@@H](NCC1(CO)CCCC1)c1cnc2ccsc2c1 160078649 PGWUTIAHLNIPCC-GFCCVEGCSA-N 290.432 3.500 70 20 CGID C[C@H]1CCN(C(=O)Nc2cc(C(C)(C)C)on2)C[C@H]1C 161084756 HGDLSDRFZSYQOF-WDEREUQCSA-N 279.384 3.482 70 20 CGID CCCn1c(C)nnc1COc1ccc(C(=O)CC)cc1 161190830 QYOVJJBCIZSGAD-UHFFFAOYSA-N 287.363 3.168 70 20 CGID Cc1nc2n(n1)C[C@H](N[C@@H]1CC[C@H](C)c3ccccc31)CC2 160493634 RYFXMQOYVGYOPF-DXCKQFNASA-N 296.418 3.130 70 20 CGID CCCC1(CNC(=O)[C@@H](OCC)c2ccccc2)CC1 160544552 INJNEHKLCQSAIU-HNNXBMFYSA-N 275.392 3.461 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCC(C)CC1 160625241 MGMFXUZFBQJYEA-UHFFFAOYSA-N 263.385 3.116 70 20 CGID CC(C)c1cc(=O)n(CCOc2ccc(Cl)cc2)cn1 160734496 JIFXGPPATBVJEP-UHFFFAOYSA-N 292.766 3.099 70 20 CGID CC(C)NCCC(=O)N[C@H](C)CCC1CCCCC1 160914926 OWHQTRARIBVDCI-CQSZACIVSA-N 268.445 3.240 70 20 CGID CCCN(CCC)C(=O)CCC(=O)N[C@H]1CCC[C@H]1CC 159713563 GDQMIDVYPZPCEO-CABCVRRESA-N 296.455 3.110 70 20 CGID CSC[C@@H](C)C(=O)O[C@@H](c1ccccn1)C(F)(F)F 159911216 OEFSVCGFWPKHEV-SCZZXKLOSA-N 293.310 3.227 70 20 CGID CO[C@@H](C)CC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 159917319 CROQVEVUUHTREV-KSSFIOAISA-N 298.386 3.021 70 20 CGID COC(=O)[C@H](N[C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccccc1 217894846 UXJZTQZSGBFHTO-OCVGTWLNSA-N 275.392 3.315 70 20 CGID CC1(C)C[C@@H](NCc2cc(F)c(F)c(F)c2)CCO1 160632584 RPVUZJHVYUFHAS-JTQLQIEISA-N 273.298 3.151 70 20 CGID CC1(C)CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 809281024 NHXQAASLGCCFSN-SNVBAGLBSA-N 299.367 3.110 70 20 CGID COCCC1(CNC(=O)N2CCCC[C@H]2C(C)C)CC1 161028943 NBCHTUFWOZQXRF-AWEZNQCLSA-N 282.428 3.023 70 20 CGID C[C@H](c1ccccc1Cl)N(C)C(=O)[C@@H]1CCCCO1 161119804 OXWHONRATXTWFU-RISCZKNCSA-N 281.783 3.429 70 20 CGID CC[C@H]1CCCN(C(=O)NCC2(CCOC)CC2)CC1 161129438 WNBHPCLXKQWFBE-AWEZNQCLSA-N 282.428 3.025 70 20 CGID COc1ccc2c(c1)CCC[C@H]2NCC1(CO)CCCC1 160071048 UBBHVDRDJQMWRL-QGZVFWFLSA-N 289.419 3.215 70 20 CGID CC[C@H](Nc1nc(C(C)(C)C)ns1)[C@@H]1CCCO1 160117700 XPHBYPDVLRYOGG-UWVGGRQHSA-N 269.414 3.205 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@H]1CCCCO1 160157163 SPXGRKLNCSVXGC-SWLSCSKDSA-N 278.348 3.177 70 20 CGID Cc1nc2c(c(N[C@@H]3CCO[C@@H](C4CC4)C3)n1)CCCC2 160375112 YMIRJTOGIVDHGB-CZUORRHYSA-N 287.407 3.033 70 20 CGID Cc1noc(Cl)c1CC(=O)N1CCC[C@H]1C1CCCC1 160793628 NDCLASOZQLIEJZ-ZDUSSCGKSA-N 296.798 3.360 70 20 CGID C[C@@H]1CCCN1C(=O)NCC1(Cc2ccccc2)CC1 160833637 VICBYSRITOOJKB-CQSZACIVSA-N 272.392 3.203 70 20 CGID CC[C@@H](C(=O)Nc1cccc(F)n1)c1ccc(OC)cc1 160874788 RMKMFCNQSGMMFW-CYBMUJFWSA-N 288.322 3.362 70 20 CGID C[C@@H](NC(=O)[C@H]1CCC[C@H](N)C1)c1ccc(F)cc1Cl 159626975 JGFRENDNLQTPKK-SCVCMEIPSA-N 298.789 3.174 70 20 CGID Cc1n[nH]c(C(C)C)c1C(=O)N[C@H]1CCc2ccccc21 159441213 IYFRUGVGGFNGDH-AWEZNQCLSA-N 283.375 3.259 70 20 CGID O=C1C[C@@H]2CC[C@H](C1)N2CCc1ccccc1Cl 217813734 DBDNBHVRMKAGAO-BETUJISGSA-N 263.768 3.078 70 20 CGID COCCc1nsc(N[C@@H]2CCCc3sccc32)n1 161072410 ZGWJCLUORAMUNA-SNVBAGLBSA-N 295.433 3.278 70 20 CGID COCCN(CC(C)C)C(=O)[C@H]1C[C@@H]1c1sccc1C 161170687 BGGKANLLTCIEDU-KBPBESRZSA-N 295.448 3.291 70 20 CGID C[C@H]1CCC[C@H](C(=O)NC[C@@H](C)CN2CCCCC2)C1 161212532 RPSIEGSTCSOSFN-XHSDSOJGSA-N 280.456 3.051 70 20 CGID Cc1ccc(NC(=O)c2ccc(C(C)C)nc2)nc1 160090109 XEOJKQFWMWOCPW-UHFFFAOYSA-N 255.321 3.161 70 20 CGID CSc1ccc(NC(=O)C2=C(C)OCCC2)cc1 160424939 WMGWBMGNPBTAQR-UHFFFAOYSA-N 263.362 3.431 70 20 CGID CCC(CC)n1nccc1C(=O)N[C@H](C)c1ccccn1 160589340 LBYYNSUUWASKLU-GFCCVEGCSA-N 286.379 3.130 70 20 CGID C[C@H](NCc1nnc(-c2ccccc2)s1)c1ccncc1 160743024 NODIAQGFDKEZRJ-LBPRGKRZSA-N 296.399 3.451 70 20 CGID CCC(CC)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160757635 VUOKPBGXOYCPNT-AWEZNQCLSA-N 267.413 3.421 70 20 CGID Cc1ccc(C(=O)Nc2cc(CC(C)(C)C)[nH]n2)cc1N 159437245 WCXFEEKEFBAFMW-UHFFFAOYSA-N 286.379 3.141 70 20 CGID CS[C@H](C)CC(=O)NCCc1ccc(Cl)s1 159907104 QXRKFYVEZNGREP-MRVPVSSYSA-N 277.842 3.202 70 20 CGID CC(=O)Nc1ccc(C(=O)CSc2ccncc2)cc1 159911277 WJAQLPHTFCXHNE-UHFFFAOYSA-N 286.356 3.015 70 20 CGID CCO[C@H](C)C(=O)N1C[C@H](C)CSc2ccccc21 159520596 MFZMCQRJZJUIDI-NWDGAFQWSA-N 279.405 3.186 70 20 CGID Cc1cc(C(N)=O)ccc1NCc1cc(Cl)ccc1F 160718934 JXTWUFNJXRMLJO-UHFFFAOYSA-N 292.741 3.499 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2cc(F)ccc2O)CC1 160989725 HCOHLZVLDSBUBQ-UHFFFAOYSA-N 277.339 3.350 70 20 CGID CC(C)(C)[C@@H](CC1CCCCC1)NC(=O)CCCN 160073749 ZNMHERXUQYOKLS-CQSZACIVSA-N 268.445 3.227 70 20 CGID C[C@H]1Sc2ccccc2N(CC[C@@H]2CCOC2=O)[C@@H]1C 161161729 KKEQVRQZBSPNLN-JHJVBQTASA-N 291.416 3.329 70 20 CGID CCC(CC)n1nccc1C(=O)Nc1ccccc1 161171312 REINIFLCVUQLAG-UHFFFAOYSA-N 257.337 3.497 70 20 CGID CCOCCCC(=O)N(C)c1ccc(OC)c(Cl)c1 160286225 QLABVRNZKBMLKZ-UHFFFAOYSA-N 285.771 3.128 70 20 CGID CC1=C(C(=O)Nc2nc3ccccc3s2)CCCO1 160429622 VKZNNJOYLSRCFT-UHFFFAOYSA-N 274.345 3.319 70 20 CGID O=C(CCC1CC1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 159443061 BZSJLKTUSWMTME-WBVHZDCISA-N 287.403 3.461 70 20 CGID O=C(Nc1cc(F)ccc1Cl)NC1CC=CC1 159866260 FMJPMLJRNGCFRU-UHFFFAOYSA-N 254.692 3.319 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCc1nc2ccccc2s1 159678507 OOBPTTPRNIFGKX-ZUZCIYMTSA-N 274.389 3.349 70 20 CGID CC[C@H](COC)NC(=O)NC1(c2ccc(Cl)cc2)CC1 159759140 XBBYIWBQZKRYGM-CYBMUJFWSA-N 296.798 3.053 70 20 CGID Cc1cc([C@H](C)N[C@H]2CCN3CCCC[C@@H]23)c(C)o1 217699284 JPJGRGKSSMZWDR-RCBQFDQVSA-N 262.397 3.174 70 20 CGID COc1ncccc1CNc1cc(Cl)nc(C2CC2)n1 217966584 CRTIIXPDUBRMLE-UHFFFAOYSA-N 290.754 3.023 70 20 CGID CC[C@H]1CN(CCC(=O)c2ccc(C)cc2)C[C@H](C)O1 159616703 YEOCRTAJVNQKJP-HOCLYGCPSA-N 275.392 3.067 70 20 CGID Cc1cccc([C@@H](C)NCc2c(C)nn(C)c2C)c1 160160264 GSPCNEIQAKJGBN-GFCCVEGCSA-N 257.381 3.196 70 20 CGID CC[C@@H](C)[C@H](NCc1coc2ccccc12)C(=O)OC 161083517 AGRIRCMZMBGWMY-ABAIWWIYSA-N 275.348 3.110 70 20 CGID CN1CCC[C@H](CN[C@H](c2ccccc2)c2ccco2)C1 217569928 ZMMUNDYXXKULLU-CRAIPNDOSA-N 284.403 3.300 70 20 CGID CSCC[C@@H](C)N(C)Cc1noc(-c2ccsc2)n1 160892291 WWALGIOOPFGNIN-SNVBAGLBSA-N 297.449 3.372 70 20 CGID O=C(Nc1ccncc1)N[C@@H]1CCCc2sccc21 161182227 QSMPQRRDNKTCNX-GFCCVEGCSA-N 273.361 3.342 70 20 CGID CC(C)OC(=O)[C@H](C)N(C)C(=O)C1CCC(C)(C)CC1 161223447 YPQOGQKFKPRWQC-LBPRGKRZSA-N 283.412 3.001 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@@H](CC(C)C)C1 161231185 GTIANRRZVSXSDD-HNNXBMFYSA-N 278.444 3.255 70 20 CGID CCCSCC(=O)N[C@H]1CCCc2sccc21 160113565 POCOGVSYINJERN-NSHDSACASA-N 269.435 3.385 70 20 CGID Cc1ccc([C@@H]2CCCN2C(=O)[C@H]2OCC[C@H]2C)s1 160422373 AJOBEDBLEMNGNE-OSMZGAPFSA-N 279.405 3.145 70 20 CGID OCc1cc2ccccc2nc1N[C@@H]1CCO[C@@H](C2CC2)C1 160442377 WGAKYQGYJIOCOY-NVXWUHKLSA-N 298.386 3.097 70 20 CGID Cc1ccc2c(c1)[C@@H](NC[C@H]1CCCC[C@@H]1O)CC2 160584428 FGVIPIKAZAHIBE-PVAVHDDUSA-N 259.393 3.123 70 20 CGID CS[C@H](C)CC(=O)NCc1ccccc1OC(C)C 160619334 RQWCSRWWQAQSHI-GFCCVEGCSA-N 281.421 3.232 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@H]2CC23CCOCC3)c1 160718021 AHXLZPUGQHJEQW-CQSZACIVSA-N 287.359 3.035 70 20 CGID CCC[C@@H](C(=O)NCc1ccccc1OC)C(C)C 160934891 KMWMYMAVGNVMPC-CQSZACIVSA-N 263.381 3.384 70 20 CGID CC(C)[C@H](C)CC(=O)N[C@@H]1CCOC2(CCCC2)C1 159874010 KJZVTIMLGCHQLJ-ZIAGYGMSSA-N 267.413 3.277 70 20 CGID Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)[C@@H](N)C(C)(C)C)C1 159889326 KQJZQBORIWIDBY-OFQRWUPVSA-N 288.435 3.073 70 20 CGID COc1ccc2c(c1)[C@H](N[C@@H]1CCCSC1)CCCO2 159531135 VGDPNMCNYTXHBR-IUODEOHRSA-N 293.432 3.394 70 20 CGID C[C@H](NCCCN(C)C(=O)OC(C)(C)C)c1cscn1 218241753 IKTYSULXCXPYDS-NSHDSACASA-N 299.440 3.051 70 20 CGID CC[C@@H](N[C@H](C)c1cccc(OC(C)C)c1)C(=O)OC 159504286 FZYYFGYYBAVXAR-IUODEOHRSA-N 279.380 3.076 70 20 CGID Cc1ccc2c(c1)[C@H](NC1CCN(C(C)C)CC1)CC2 160767772 OIGQGOXBOJHVKT-GOSISDBHSA-N 272.436 3.445 70 20 CGID C[C@@H](c1ccccc1F)N(C)CCOCC1CC1 159361389 NXAAXGNGMDEFIU-LBPRGKRZSA-N 251.345 3.245 70 20 CGID CCOc1cc(C)ccc1NC(=O)NC[C@@H](C)SC 161075100 OBKCRERCPPBJJI-LLVKDONJSA-N 282.409 3.267 70 20 CGID Cc1nnc(CN2c3ccccc3S[C@@H](C)[C@@H]2C)n1C 161174096 OJLKRJHKCFLYGA-QWRGUYRKSA-N 288.420 3.013 70 20 CGID CC[C@@H](NCCOc1cc(C)cc(C)c1)c1cnn(C)c1 161239860 XQLIEQHRSMJVQV-QGZVFWFLSA-N 287.407 3.157 70 20 CGID CC[C@H]1CCC[C@@H](NC(=O)NCCc2ccncc2C)C1 161463538 YNMNERWEGVBQLM-GOEBONIOSA-N 289.423 3.201 70 20 CGID CC(C)C[C@@H](NC[C@H]1CCCC[C@@H]1O)c1ccccn1 160466634 TZHUGHWLKYBVSG-OIISXLGYSA-N 276.424 3.310 70 20 CGID CCC(CC)CC(=O)N(CC(F)(F)F)C1CC1 160794761 XXNWNAKBKGEGDD-UHFFFAOYSA-N 251.292 3.366 70 20 CGID Cc1nc2ccccn2c1CN1C[C@@H](C)CC[C@@H]1C 160898513 PYVQBHRPXWIPKT-STQMWFEESA-N 257.381 3.263 70 20 CGID CCc1noc(C)c1CNc1cc(F)c(OC)c(F)c1 159412606 KTSPXNVZEVFRDT-UHFFFAOYSA-N 282.290 3.444 70 20 CGID CCSCCN1CCCN(CC2CCCCC2)CC1 159472010 YIXSPGDTHRAVRL-UHFFFAOYSA-N 284.513 3.328 70 20 CGID C[C@H]1CCC[C@H](N(C)C(=O)c2ccc(CN(C)C)cc2)C1 159908302 CGHIXZSOPQFFCR-YOEHRIQHSA-N 288.435 3.399 70 20 CGID CCCCN(C(=O)[C@@H]1CCCCO1)c1ccccc1 159744146 ZVVGFXHTKQNCJD-HNNXBMFYSA-N 261.365 3.389 70 20 CGID C[C@H](c1cc(F)ccc1F)N(C)CCOCC1CC1 159364202 MMUSLNBNTIUITE-LLVKDONJSA-N 269.335 3.384 70 20 CGID CCCCn1ncc(NC(=O)N[C@H]2CCCSC2)c1C 159772524 HLXACCHVYQAEPR-LBPRGKRZSA-N 296.440 3.009 70 20 CGID C[C@@](CO)(NCc1cc(F)cc(Cl)c1)c1ccccc1 159794219 OFMMUYKWOAOHKY-INIZCTEOSA-N 293.769 3.476 70 20 CGID CCO[C@@H]1C[C@@H](N[C@H](C)c2cccnc2)C12CCC2 160898203 KPEPYRNLGIQTJX-BPLDGKMQSA-N 260.381 3.080 70 20 CGID O=S(=O)(Cl)C[C@H](F)c1csc2ccccc12 1537959022 UKVAOPRSTAOADK-VIFPVBQESA-N 278.757 3.481 70 20 CGID CC(C)c1ccc([C@H](F)CS(=O)(=O)Cl)cc1 1537958759 JFZGTKQMNCYKLS-LLVKDONJSA-N 264.749 3.389 70 20 CGID Cn1ncc2c1CCC[C@H]2NCc1cccc2cc[nH]c12 218104968 WEADTBLHMSYGLR-OAHLLOKOSA-N 280.375 3.069 70 20 CGID CCCN(CCC)C(=O)c1c(C)nn(CCC)c1C 161180975 XKCPKJLLKFTVOM-UHFFFAOYSA-N 265.401 3.172 70 20 CGID O=C(CC1CC1)N1CC[C@H](Oc2ccccc2Cl)C1 161376738 GVBJXBYVLITCSM-LBPRGKRZSA-N 279.767 3.120 70 20 CGID CC1(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CCOCC1 161510117 NNXCRYUYUQHDMA-RBSFLKMASA-N 279.424 3.278 70 20 CGID Cc1ccccc1NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 160929159 PHRVJTDQIUQRGP-DZGCQCFKSA-N 274.364 3.074 70 20 CGID Cc1ncc([C@@H](C)NC2CC(C)(C)NC(C)(C)C2)c(C)n1 159608584 FFGHFLCLEAAIQK-GFCCVEGCSA-N 290.455 3.053 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCCc3sccc32)o1 159823604 RMEUWCORYGSOTD-NSHDSACASA-N 261.346 3.457 70 20 CGID CCCCCC(=O)N(C)c1ccc(OC)c(F)c1 159674745 OGCIRJBLVHQKLT-UHFFFAOYSA-N 253.317 3.377 70 20 CGID O=C(c1coc2ccccc12)N1CCC(NCC2CC2)CC1 159879464 KNIDGXRHTPMWGE-UHFFFAOYSA-N 298.386 3.037 70 20 CGID CCCCOCC(=O)N[C@H]1CCCc2sccc21 159909582 GUXSDBISRRIRMG-LBPRGKRZSA-N 267.394 3.058 70 20 CGID c1cnc2c(CN[C@H]3[C@@H]4CCO[C@@H]4C34CCC4)cccc2c1 159541030 PBTNIFNJNDYMIP-SZMVWBNQSA-N 294.398 3.282 70 20 CGID CSCCCCC(=O)Nc1ccccc1-n1ccnc1 159581815 BOWCGHHYZCHIGO-UHFFFAOYSA-N 289.404 3.344 70 20 CGID Cc1cnc(CN[C@H]2C[C@H]3CC[C@@]2(C)C3(C)C)cn1 218493263 XWWCYOKGTCYGQX-IVMMDQJWSA-N 259.397 3.089 70 20 CGID COc1ccc(CN(C)C(=O)N2CCCCCC2)cc1 160387506 YRTYFFGAYQAXCG-UHFFFAOYSA-N 276.380 3.123 70 20 CGID COc1ccc(NC(=O)Nc2cc(Cl)ccn2)cc1 217267715 YJXKZDQIMLYPTM-UHFFFAOYSA-N 277.711 3.388 70 20 CGID Cc1ccc(CCNC(=O)NCC2CCCC2)cc1 217578308 MQKPVPYBNDANDK-UHFFFAOYSA-N 260.381 3.027 70 20 CGID O=C(Cc1ccc(O)cc1)N[C@H]1CCCc2sccc21 160440235 XNXNLSUGWUSIMI-AWEZNQCLSA-N 287.384 3.190 70 20 CGID Cc1cc(O)ccc1NC(=O)[C@@H](C)Sc1ccccn1 161019079 IQXCITFVEYUSIL-LLVKDONJSA-N 288.372 3.215 70 20 CGID CCCC(O)(CCC)CC(=O)NCC(CC)CC 161433274 NFCBAGUTJKVFPT-UHFFFAOYSA-N 257.418 3.260 70 20 CGID CCOCCC1(CNC(=O)C2(CC)CCC2)CCC1 160103032 GBGMKSKOBAZRBD-UHFFFAOYSA-N 267.413 3.280 70 20 CGID COCCC1(C(=O)N[C@H]2CCc3ccccc32)CCCC1 160261843 HAUUGEXHKCQFAJ-INIZCTEOSA-N 287.403 3.387 70 20 CGID C[C@H]1Sc2ccccc2N(C(=O)[C@@H]2CCCO2)[C@@H]1C 160263793 ALNNSSUZZWFVPD-WZRBSPASSA-N 277.389 3.081 70 20 CGID CC[C@H](CN[C@H](C)c1cnn(C)c1)Oc1ccccc1F 160317250 GABHVGVUSGSCKU-TZMCWYRMSA-N 291.370 3.067 70 20 CGID CN(C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1)C1CC1 160508739 XXECSZJAVFUUHD-GDBMZVCRSA-N 272.392 3.202 70 20 CGID CC1(C)CCC(C(=O)N2CCC(c3ccn[nH]3)CC2)CC1 160580500 BVQWWCORZOKWKV-UHFFFAOYSA-N 289.423 3.332 70 20 CGID CSCCCCC(=O)NC[C@@H](C)N(C)c1ccccc1 159884403 JDNMJRRUUBDCNW-CQSZACIVSA-N 294.464 3.161 70 20 CGID CCCN(C)C[C@@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159748061 PZOGHTHCRAQRED-LBPRGKRZSA-N 296.484 3.004 70 20 CGID CSCCCCC(=O)N(Cc1cccnc1)C1CC1 159378088 YZFNIZRABXNOFL-UHFFFAOYSA-N 278.421 3.106 70 20 CGID CCO[C@@H]1C[C@H](NCc2ccc(C)c(F)c2)C1(C)C 217892753 CGGOGFKMJAQDHU-LSDHHAIUSA-N 265.372 3.427 70 20 CGID COc1cc(NC(=O)N(C)c2ccccc2)cc(OC)c1 217273902 GCNPYPCDEUKJOM-UHFFFAOYSA-N 286.331 3.372 70 20 CGID COc1ccc(N(C)C(=O)c2occc2C)cc1F 159474227 KPWJXORSHUKACK-UHFFFAOYSA-N 263.268 3.012 70 20 CGID CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(C)(C)CC1 161058585 DLRKLBUOUQFQGU-CVEARBPZSA-N 292.467 3.288 70 20 CGID C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)[C@H]1CC=CCC1 161205002 DKAJFFSQYOHQSZ-OCCSQVGLSA-N 289.350 3.260 70 20 CGID Cc1ccnc(NC(=O)c2ccc(C(C)C)nc2)c1 160080507 DNGBHDMKRGDZSN-UHFFFAOYSA-N 255.321 3.161 70 20 CGID COCCN(Cc1ccccc1)Cc1ccc(COC)o1 160438880 MCPUYXFBQIIXER-UHFFFAOYSA-N 289.375 3.075 70 20 CGID C[C@H]1CCN(C(=O)Nc2cccc(F)c2F)C[C@@H]1C 160466084 NQNHYBNZDKTLHG-UWVGGRQHSA-N 268.307 3.475 70 20 CGID C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@H]1CCCCO1 160593356 LZTRHUSLKIQCRB-QMTHXVAHSA-N 283.318 3.053 70 20 CGID Cc1csc(CCCCN[C@@H]2C[C@H](C)N(C)C[C@@H]2C)n1 160667886 TWJWHUUWELFZTQ-AEGPPILISA-N 295.496 3.093 70 20 CGID Cc1c(C(=O)N(C)[C@H](C)c2ccco2)cnn1CC(C)C 159869654 RDILAUKVKYSRJA-CYBMUJFWSA-N 289.379 3.274 70 20 CGID Cc1ccc(NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cn1 159941743 RVNPFWMMBVOOJO-UHFFFAOYSA-N 297.358 3.091 70 20 CGID C[C@H](CNc1ccccc1)NC(=O)C[C@@H](C)c1ccncc1 159584485 FTIVZWIDSZFJAJ-HUUCEWRRSA-N 297.402 3.192 70 20 CGID CN(C)[C@@H](CNCc1coc2ccccc12)c1ccco1 159795420 ZDGCYPHWHXKKRL-HNNXBMFYSA-N 284.359 3.418 70 20 CGID CC(C)n1ccnc1CN(C)CCc1ccccc1 160804116 GRELUMDQVYXORZ-UHFFFAOYSA-N 257.381 3.139 70 20 CGID CCCCOCC(CC)(CC)CS(=O)(=O)Cl 114473774 QYXQPIYFCJQZCP-UHFFFAOYSA-N 270.822 3.178 70 20 CGID Cc1ccc(CCNC(=O)N2CCC[C@@H](C)CC2)cc1 217225177 NSDKEYRLIFVOLL-CQSZACIVSA-N 274.408 3.369 70 20 CGID CSC[C@@H](C)Nc1cc(Cl)nc(C2CC2)n1 159883356 LECRRLQLZRGVIQ-SSDOTTSWSA-N 257.790 3.171 70 20 CGID C[C@H]1CCCC[C@@H]1NC(=O)NCCCOc1ccccc1 217299732 VITMWBWYWCWVNH-HOCLYGCPSA-N 290.407 3.333 70 20 CGID Cc1ccc(Cl)c(O[C@@H](C)C(=O)NC2CC=CC2)c1 161066434 HOYJRQBGIHOZGM-NSHDSACASA-N 279.767 3.251 70 20 CGID Cc1ccc(NC(=O)N(C)C(C2CC2)C2CC2)cn1 161367868 KAPUBPPNFDBRCL-UHFFFAOYSA-N 259.353 3.042 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@@H]1CCCS1 160152576 RHXPZMVNWRENJJ-PWSUYJOCSA-N 267.419 3.137 70 20 CGID Cc1sc2nc(-c3ccc4c(c3)CCO4)[nH]c(=O)c2c1C 160322491 TVIAAPZUCKGJJH-UHFFFAOYSA-N 298.367 3.203 70 20 CGID CC(C)C[C@H]1CCCCN1CCC(=O)N1CCC[C@H]1C 160328132 LRRYULDKBROLSB-HZPDHXFCSA-N 280.456 3.288 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)N[C@@H]1CCCc2ccccc21 160371056 NJLGQMGMEFDUKT-YLQAJVPDSA-N 285.387 3.186 70 20 CGID CC1=C(C(=O)Nc2nc3c(s2)CCCC3)CCCO1 160437283 DIGAIKNIVWYFJM-UHFFFAOYSA-N 278.377 3.045 70 20 CGID CCOc1ccc(Cl)cc1[C@@H](C)NCC(C)(C)O 160609419 KOCCQECKFOORTE-SNVBAGLBSA-N 271.788 3.160 70 20 CGID CC[C@H](NC(=O)CCCCCCN)c1cc(F)ccc1F 160656779 QBUCIWMMMVSBKX-HNNXBMFYSA-N 298.377 3.441 70 20 CGID COC(=O)c1ccc(NC(=O)C2CCC(F)(F)CC2)cc1 160996431 PLGHEDSIYYMTQD-UHFFFAOYSA-N 297.301 3.237 70 20 CGID C[C@@H]1SCCN(CCn2ccnc2)[C@H]1c1ccccc1 159834584 YXFMJZNZDCUPCO-GOEBONIOSA-N 287.432 3.062 70 20 CGID CCC[C@@H](C)NC(=O)[C@H](C)N[C@@H](C)c1cccc(F)c1F 159459812 QSDHZXYZVBZHGI-WOPDTQHZSA-N 298.377 3.309 70 20 CGID CCOC[C@H]1CCCN(CCC(=O)c2ccc(C)cc2)C1 159677410 VRCYKESFRIEUEO-INIZCTEOSA-N 289.419 3.316 70 20 CGID CN(C(=O)Nc1ccc(F)c(Cl)c1)[C@H]1CCSC1 159391739 PZHVWAMAKIOJKH-VIFPVBQESA-N 288.775 3.448 70 20 CGID Cc1c(CN[C@H]2CCc3cc(Cl)ccc32)cnn1C 161215356 ALEQPCJSYWDNAR-HNNXBMFYSA-N 275.783 3.159 70 20 CGID CC(C)(C)[C@@H]1CCN(C(=O)c2ccc3[nH]cnc3c2)C1 161444398 JDZYOOHFAVBXHR-GFCCVEGCSA-N 271.364 3.071 70 20 CGID CC(C)(C(=O)NC1CC=CC1)c1ccc(Cl)cc1 161059615 LTINLGHGTHUHCH-UHFFFAOYSA-N 263.768 3.452 70 20 CGID CC[C@H](C)N(C)CCNC(=O)c1ccc2nc(C)ccc2c1 161469354 SASPPOVQAUDPIC-AWEZNQCLSA-N 299.418 3.003 70 20 CGID CC1(CC(=O)Nc2cccc(NC(N)=O)c2)CCCCC1 160047612 SCYXHPDMNLDVHV-UHFFFAOYSA-N 289.379 3.476 70 20 CGID COc1ccc(N(C)C(=O)c2cscn2)cc1Cl 160111067 KFKJRCULKAOLPT-UHFFFAOYSA-N 282.752 3.082 70 20 CGID Cc1cc2c(N[C@H]3CCO[C@@H](C4CC4)C3)ncnc2s1 160357773 NYBVFAQSLXWOFC-WCQYABFASA-N 289.404 3.369 70 20 CGID OCc1cc2ccccc2nc1N[C@H]1CCO[C@H](C2CC2)C1 160442257 WGAKYQGYJIOCOY-RDJZCZTQSA-N 298.386 3.097 70 20 CGID CCCC[C@H](CC)C(=O)N(C)Cc1cccn1C 160458876 ZGPICXUNPDWCBA-ZDUSSCGKSA-N 250.386 3.200 70 20 CGID C[C@@H](NCC1(Sc2ccccc2)CC1)c1cnccn1 160486637 BBNDWIYKPGFKDI-CYBMUJFWSA-N 285.416 3.452 70 20 CGID CC(C)[C@@H](O)CCNC(=O)CC[C@@H](C)c1ccccc1 160836263 LGEAHNDFORCLTM-ZBFHGGJFSA-N 277.408 3.094 70 20 CGID CC[C@H](C)CN(CC)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 160925767 OGMMPSJENMOFOG-XQLPTFJDSA-N 294.439 3.022 70 20 CGID Cc1cccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)c1 159805117 URUXBLGSNPKWBH-HNNXBMFYSA-N 273.376 3.217 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2Nc1ncc(Cl)cn1 159514726 JOYVYIZMJLWRPI-CYBMUJFWSA-N 274.755 3.202 70 20 CGID Cc1ccccc1N(CCn1c(C)csc1=O)C(C)C 216924304 BAGPZABZKSMESF-UHFFFAOYSA-N 290.432 3.442 70 20 CGID CC[C@H](NC(=O)[C@@H]1CCCCO1)c1cccc(Cl)c1 161066254 YFROOYHKBWAKPS-KBPBESRZSA-N 281.783 3.476 70 20 CGID CCCC(CCC)S(=O)(=O)CCc1c(C)noc1C 160005806 JMBUWUPMLWALBJ-UHFFFAOYSA-N 287.425 3.218 70 20 CGID Cc1ccc(C(=O)CCN2CCO[C@H](c3ccco3)C2)cc1 160099133 VEYFMWKZCHZLSO-SFHVURJKSA-N 299.370 3.234 70 20 CGID CCCc1ccc([C@@H](NCc2nncn2C)C(C)C)cc1 160714522 ZITXLDLVBFFSQI-KRWDZBQOSA-N 286.423 3.255 70 20 CGID Cn1ccc(NC(=O)NCC(C)(C)C2CCCCC2)n1 160751550 GIUBJXXMJVQELL-UHFFFAOYSA-N 278.400 3.148 70 20 CGID CC(C)CCn1ccc(NC(=O)NC[C@H]2CC=CCC2)n1 160791501 MITNIVZRKDSQRN-AWEZNQCLSA-N 290.411 3.407 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)o1 160863167 MSNJKVDIPQFCAW-CYBMUJFWSA-N 277.364 3.200 70 20 CGID CCn1cc([C@H](C)NC[C@H]2CCc3ccccc32)cn1 160982173 ZWYVQYHCWZRUMX-DZGCQCFKSA-N 269.392 3.284 70 20 CGID C[C@H](Cc1cccc(Cl)c1)C(=O)N[C@H](C)C1CC1 159702227 WFOSXBQCSZVCLY-GHMZBOCLSA-N 265.784 3.433 70 20 CGID Cc1cc(C(=O)CN(C)[C@@H]2CCC[C@@H](C)C2)c(C)n1C 218588071 HDYKNLQWWFLFHA-IUODEOHRSA-N 276.424 3.335 70 20 CGID CC[C@@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(Cl)cc1 159986177 LVAFHEKHTLUPFL-IJLUTSLNSA-N 282.815 3.294 70 20 CGID Cc1ccc2c(c1)[C@H](N[C@H]1CCC[C@H](N(C)C)C1)CC2 161098132 JLOQWENBUOBATN-XYJFISCASA-N 272.436 3.445 70 20 CGID CN1CCN(Cc2ccccc2F)[C@@H](c2ccccc2)C1 216730933 JXDRQYGBPXSZIZ-GOSISDBHSA-N 284.378 3.314 70 20 CGID Cc1ccc(C)c(-c2cnn(CC3CCNCC3)c2)c1 217237626 WDZLJKSGTVBBEU-UHFFFAOYSA-N 269.392 3.167 70 20 CGID CC[C@H](C)NC(=O)C(=O)Nc1ccccc1SC(C)C 161007217 PUPPJDAZTJZPOO-NSHDSACASA-N 294.420 3.040 70 20 CGID CC(C)NCCC(=O)Nc1cc(C2CCCCCC2)[nH]n1 161071407 YSCHPAAOACMOAU-UHFFFAOYSA-N 292.427 3.174 70 20 CGID Cc1ccc([C@@H](C)NCCc2ccc3c(c2)OCO3)o1 161150239 IKPYIEKVSHITCF-GFCCVEGCSA-N 273.332 3.210 70 20 CGID CCn1cc(NC(=O)N[C@H]2CCCc3sccc32)cn1 161178054 WGYHAZVEPFVHKI-LBPRGKRZSA-N 290.392 3.164 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)Cc1cccc(Br)c1 161474182 TTWXSCVLJBHKRQ-GHMZBOCLSA-N 296.208 3.391 70 20 CGID C[C@H](CC1CC1)NC(=O)N1CCO[C@H](c2cccs2)C1 160412600 ABLBVBSBXHETHN-YPMHNXCESA-N 294.420 3.020 70 20 CGID COCC(C)(C)C(=O)N[C@H]1CC(C)(C)c2ccccc21 160562738 JTTDLBOBPJFOEV-AWEZNQCLSA-N 275.392 3.198 70 20 CGID Cc1nc(CC(=O)Nc2cc(F)ccc2F)c(C)s1 160792344 JUEFWBBQOKSRMH-UHFFFAOYSA-N 282.315 3.219 70 20 CGID Cc1cc(Cl)cc(C(=O)NCc2ccc(O)c(F)c2)c1 159803455 GSHAPBRVPSFVGP-UHFFFAOYSA-N 293.725 3.423 70 20 CGID CC(C)CCO[C@H](C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159459208 CANRVBCEFRVBFX-CABCVRRESA-N 297.439 3.046 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 159850404 LYHNDHGARFPDJX-PLQHRBFRSA-N 289.375 3.071 70 20 CGID CCOCCN(CC)C(=O)[C@H](CC)c1ccc(F)cc1 159875563 BNTYRUNCZOXPJV-OAHLLOKOSA-N 281.371 3.204 70 20 CGID C[C@@H](N[C@H]1CCOC(C)(C)C1)c1ccc(-n2ccnc2)cc1 159934117 JKPFUKNUCVAVFO-ZBFHGGJFSA-N 299.418 3.481 70 20 CGID CN(C)[C@@H](CNCc1cc(F)cc(F)c1)c1ccccc1 159599362 YADZHQWMZISGHS-KRWDZBQOSA-N 290.357 3.357 70 20 CGID CC[C@@H](C)N(C)CCNc1nc2ccc(N)cc2s1 218729058 DTBQJWMCFZLQDA-SNVBAGLBSA-N 278.425 3.021 70 20 CGID COc1cc(NC(=O)c2cccc(C)c2O)ccc1F 160408268 ZENXVLHEQVHGCR-UHFFFAOYSA-N 275.279 3.101 70 20 CGID CC[C@H](C)[C@@H](C(=O)N1CCC[C@@H](CN)C1)c1ccccc1 217534870 YDPPUILLVGVSHU-YQQAZPJKSA-N 288.435 3.014 70 20 CGID C[C@@H](NCC(C)(C)O)c1cc(Cl)ccc1OC(F)F 160639177 UDMVBRMUXGMREW-MRVPVSSYSA-N 293.741 3.363 70 20 CGID Cc1cc(NC(=O)C[C@H](C)c2c(C)n[nH]c2C)ccc1O 160673672 MGGBVSMXBZIQIQ-JTQLQIEISA-N 287.363 3.173 70 20 CGID CCN(Cc1ccoc1)C(=O)c1cnn(CC(C)C)c1C 160810353 CFTXFHHGVNYQKF-UHFFFAOYSA-N 289.379 3.103 70 20 CGID COc1cc(C)nc(Cn2cnc3cc(F)c(F)cc32)c1 160973900 PDLQFFIEZACBBB-UHFFFAOYSA-N 289.285 3.075 70 20 CGID Cc1ccc(C)c(NC(=O)N(C)CCc2nccs2)c1 159690571 PXSZUCGLLCTZCN-UHFFFAOYSA-N 289.404 3.466 70 20 CGID CC[C@@H](C)OCC(=O)Nc1ccc(N2CCCC2)c(F)c1 159697310 QLIIADBYVTXLGF-GFCCVEGCSA-N 294.370 3.180 70 20 CGID C[C@@H]1CCC[C@@H](CNC(=O)NCc2ccccc2)C1 218047551 DJJQJBKFYGCRFX-UKRRQHHQSA-N 260.381 3.312 70 20 CGID c1sc(C2CC2)nc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159589476 UFWMHSAFKUIBGK-MCIONIFRSA-N 290.432 3.068 70 20 CGID CNc1ccc(C(F)(F)F)cc1C(=O)NC[C@@H]1C[C@@H]1C 160090383 GWTGQGMQTMMMAU-IUCAKERBSA-N 286.297 3.133 70 20 CGID CC1=CCN(C(=O)c2ccc3ccccc3c2O)CC1 160228909 KFPAWBFVPVPPAJ-UHFFFAOYSA-N 267.328 3.338 70 20 CGID CC(C)COc1ccc(NC(=O)CCc2ccco2)cn1 217225992 QAEQUKLFIBQZCX-UHFFFAOYSA-N 288.347 3.281 70 20 CGID COc1cc(NC(=O)c2cccs2)ccc1F 160557625 YNQNIBBTNIVMNR-UHFFFAOYSA-N 251.282 3.148 70 20 CGID CCC(=O)Nc1ccc(S(=O)(=O)Cl)c2ccccc12 97945857 ISEKKLOLZZWWGJ-UHFFFAOYSA-N 297.763 3.116 70 20 CGID COc1cccc(-c2noc([C@@H]3CCC(=O)C[C@H]3C)n2)c1 161014017 LFWBHBLRYZCUMJ-QMTHXVAHSA-N 286.331 3.218 70 20 CGID Cc1cccc(C(=O)Nc2nc(C)c(C)s2)c1F 161411854 IMABWDXADRAPGL-UHFFFAOYSA-N 264.325 3.460 70 20 CGID C/C=C(\C=C\C(=O)N[C@@H](C)CCc1cccn1C)CC 161506870 CUWNLAUXRQILPN-GBKSYPNASA-N 274.408 3.375 70 20 CGID CC[C@@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)C1 160110906 LUAXXWBHRJLASZ-CQSZACIVSA-N 280.456 3.003 70 20 CGID O=C(NCCOc1ccccc1Cl)N[C@H]1C=CCCC1 160268593 HEKVYBDWMWCZTI-LBPRGKRZSA-N 294.782 3.127 70 20 CGID O=C(NCC1(CO)CCCC1)c1ccc2ccccc2c1 160299170 QCNZKOYUNFXLFR-UHFFFAOYSA-N 283.371 3.122 70 20 CGID CCc1cc(O)nc(CNC(C)(C)CC(C)(C)C)n1 160900121 UFSKPJIVNFRBRP-UHFFFAOYSA-N 265.401 3.049 70 20 CGID CCOc1ccc(NC(=O)CO[C@H](C)CC)c(C)c1 159750940 AEMRXAVHZVRRFA-GFCCVEGCSA-N 265.353 3.147 70 20 CGID c1ccc([C@@H](N[C@H]2CCSC2)c2ccccn2)cc1 218593261 KXSPKDPQBCQSNL-GOEBONIOSA-N 270.401 3.266 70 20 CGID CCc1ncnc(NC[C@H](C)c2ccccc2)c1F 217957926 JOKRLHDXVKHAGP-NSHDSACASA-N 259.328 3.394 70 20 CGID COCCN(Cc1ccccc1)Cc1scnc1C 160452318 TVROSGRPHMDGKZ-UHFFFAOYSA-N 276.405 3.100 70 20 CGID CCn1nc(C)c(CN(C)Cc2ccccc2C)c1C 160521081 IWJPNGZFNNQKCX-UHFFFAOYSA-N 271.408 3.460 70 20 CGID CC[C@@H](NC[C@H](C)N(C)Cc1ccccc1)C1CC1 160889289 JHPLEEQHNDTLCK-WMLDXEAASA-N 260.425 3.285 70 20 CGID Cc1cc(C)cc(OCCN[C@@H](C)c2cnc(C)nc2C)c1 161244571 YZGBCRNIEQUFAD-AWEZNQCLSA-N 299.418 3.440 70 20 CGID C[C@@H](CN[C@@H](C)C1CCOCC1)COCc1ccccc1 161315463 PHKNNEDZLWMLMS-HOTGVXAUSA-N 291.435 3.244 70 20 CGID CCCCn1ncc(NC(=O)N2[C@@H](C)CC[C@H]2C)c1C 160109927 HFYSKRLGLIRHRS-TXEJJXNPSA-N 278.400 3.396 70 20 CGID CC[C@@H](C(=O)NCCCSC)c1ccc(F)cc1 160183581 AWBDKFRAXDYNKK-CYBMUJFWSA-N 269.385 3.189 70 20 CGID C[C@H](N[C@@H](C)c1ccco1)c1ccc([S@](C)=O)cc1 160204092 QBXAIQXRPLQNGP-SYTFOFBDSA-N 277.389 3.429 70 20 CGID CC[C@@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@H](C)O1 160262902 KHBBTSZLQPXXHX-GXTWGEPZSA-N 267.413 3.229 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(N(C)C)nc1 160900498 SWKMWRMIJHXGER-UKRRQHHQSA-N 289.423 3.188 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc(N(C)C)nc1 160900620 SWKMWRMIJHXGER-DZGCQCFKSA-N 289.423 3.188 70 20 CGID COCCOc1ccc([C@H](C)N[C@H]2CCCSC2)cc1 159555353 XZZDYNYAHSJPIO-ZFWWWQNUSA-N 295.448 3.258 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H](C)[C@@H]2CCOC2)C1 159389488 PLOSILGSXVRRFR-CRWXNKLISA-N 257.443 3.065 70 20 CGID C[C@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc2[nH]cnc12 159575677 LZIOJLVRMWRYBZ-HUBLWGQQSA-N 283.375 3.356 70 20 CGID CCCCNC(=O)COc1ccc([C@@H](C)CC)cc1 217342510 DISZKQXIBYYCOD-ZDUSSCGKSA-N 263.381 3.495 70 20 CGID C[C@H](C1CC1)N(Cc1ccccc1)Cc1cc[nH]n1 159685346 ARIHTUXWCYBJSY-CYBMUJFWSA-N 255.365 3.210 70 20 CGID C[C@@H](N[C@H](C)C1CC1)c1cnn(Cc2ccccc2)c1 160137303 QIVCIKOLBWHXHU-ZIAGYGMSSA-N 269.392 3.381 70 20 CGID Cc1cc2ccccc2nc1N[C@@H]1CCN(C)[C@H](C)C1 160245759 DJIHPHSCTBATIJ-UKRRQHHQSA-N 269.392 3.438 70 20 CGID CCCCNC(=O)c1c(F)cccc1Br 160637336 PBNBXGMELDBLLJ-UHFFFAOYSA-N 274.133 3.118 70 20 CGID O=C(c1ccnc(Cl)c1F)N1CCCCCCC1 161224500 VJZJUDJHEKOPEI-UHFFFAOYSA-N 270.735 3.280 70 20 CGID Cc1nc(NC(=O)Cc2ccc(O)cc2Cl)sc1C 161078189 SILRPPDZOVDHDW-UHFFFAOYSA-N 296.779 3.300 70 20 CGID COc1ccc([C@H](C)N(C)C(=O)c2cccc(F)n2)cc1 161320105 WLBGCMCJSNQFLE-NSHDSACASA-N 288.322 3.063 70 20 CGID CCCn1nccc1CNc1cccc(-n2cccn2)c1 160072711 QJSSPTJGZUWVRE-UHFFFAOYSA-N 281.363 3.091 70 20 CGID COc1ccc(CC[C@H](C)NC(=O)NC2(C)CCC2)cc1 160218988 KFVITBWLBZMGBZ-ZDUSSCGKSA-N 290.407 3.258 70 20 CGID CC(C)CCN(C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)C1CC1 160292696 SNOYSEIHOHPGNK-ZBFHGGJFSA-N 294.439 3.164 70 20 CGID O=C(CC1CCC1)N[C@@H]1CCOC2(CCCCC2)C1 160407928 ROCXWQSAOKNZPP-CQSZACIVSA-N 265.397 3.175 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](C)[C@@H](C)CC)c1 160566184 QRCVWGDZMUVWEN-UONOGXRCSA-N 276.424 3.351 70 20 CGID FC(F)(F)c1cccnc1NCCCNc1ccccn1 160765865 XXSKUJDXPLDLFD-UHFFFAOYSA-N 296.296 3.410 70 20 CGID C[C@@H](SCCCCS(C)(=O)=O)c1ccccc1 160908843 JNEKOTQGEMKYQV-GFCCVEGCSA-N 272.435 3.306 70 20 CGID CC[C@@H](Nc1ccn(CCOC)n1)c1ccc(F)cc1 160927503 FIJBMRDRDVRSHF-CQSZACIVSA-N 277.343 3.232 70 20 CGID Cc1nnc(CSc2ccc(Br)cc2)n1C 160952048 ZUAIWSIZLXYFCC-UHFFFAOYSA-N 298.209 3.178 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(C)cc2O)cc1F 159401639 KOSHNJYBBYUBNL-UHFFFAOYSA-N 289.306 3.125 70 20 CGID Cc1nnc([C@H](C)N[C@H](C)c2cccc(F)c2F)o1 159405128 BAKURZYXSLMGJA-SFYZADRCSA-N 267.279 3.068 70 20 CGID C[C@H](NC[C@H](C)N1CCc2ccccc2C1)c1ccco1 159819930 HOOMTGWQLFIGGG-GJZGRUSLSA-N 284.403 3.377 70 20 CGID Cc1cc(C)c(C(=O)NCCc2nc3ccccc3s2)[nH]1 159688117 ZUAYCWCXCDLARA-UHFFFAOYSA-N 299.399 3.214 70 20 CGID Cc1cnc(COC(=O)[C@H]2C[C@@H]2c2sccc2C)cn1 159393875 UDFQOELEVLSJCM-STQMWFEESA-N 288.372 3.002 70 20 CGID CCO[C@H]1C[C@H](NCc2ccc(C)c(F)c2)C1(C)C 217892826 CGGOGFKMJAQDHU-GJZGRUSLSA-N 265.372 3.427 70 20 CGID CN(Cc1csc2ccccc12)C[C@@H]1CCC[C@@H]1O 159684184 SUNZOTGMRFEHAN-WFASDCNBSA-N 275.417 3.494 70 20 CGID CCCn1nccc1CN[C@@H]1CCc2ccccc21 159981292 QQZFCUAOOZJCAP-MRXNPFEDSA-N 255.365 3.070 70 20 CGID CCCn1nccc1CN[C@@H](C)c1cccc(OC)c1 160094901 LLCHPDQNZCLMBH-ZDUSSCGKSA-N 273.380 3.153 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCc2ccc(F)cc21 160112072 FERMXAPMNNCQQN-MLGOLLRUSA-N 264.388 3.133 70 20 CGID CCSCC[C@@H](C)NC[C@H](O)c1ccc(F)c(F)c1 160127098 DLUGSWBGKZGCKZ-YGRLFVJLSA-N 289.391 3.120 70 20 CGID CCCN(CC(=O)OCC)C(=O)c1cccc(C)c1Cl 160405575 QCNZQPLFGXWEPD-UHFFFAOYSA-N 297.782 3.064 70 20 CGID CC(C)C[C@H](CN)NC(=O)c1cc2ccc(F)cc2s1 161204467 NKYCUDBBVMDXBS-GFCCVEGCSA-N 294.395 3.144 70 20 CGID COc1cc(C)c(CN(C)Cc2ccccn2)cc1OC 218064719 ZKXIDIPKUFXVID-UHFFFAOYSA-N 286.375 3.039 70 20 CGID Brc1ccccc1-c1noc(C2CC2)n1 218546135 UZQNGSPTGULIRE-UHFFFAOYSA-N 265.110 3.377 70 20 CGID CS[C@H](C)CNC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 161373606 LVUONEUXNFQKBL-XJFOESAGSA-N 269.454 3.461 70 20 CGID CCCOc1ccc2c(c1)CCN(C(=O)NC(C)(C)C)C2 161099434 OHIWJFVFXMMJGC-UHFFFAOYSA-N 290.407 3.342 70 20 CGID C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc2[nH]ccc2c1 160038155 QEUBKFZWEVQIKH-BETUJISGSA-N 286.375 3.336 70 20 CGID CC(C)[C@H](C)CC(=O)N(C)c1ccc2c(c1)OCO2 160086388 YBCOQIPDRBQOJK-LLVKDONJSA-N 263.337 3.060 70 20 CGID CCN1CC[C@H](NCCSc2ccccc2)[C@H](C)C1 160514220 POOMDRSTNZMWJF-ZBFHGGJFSA-N 278.465 3.099 70 20 CGID Cc1nnc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)s1 160534542 DSVUCCCNHMYZDG-CHWSQXEVSA-N 275.377 3.179 70 20 CGID CCC[C@@H](C(=O)NCCc1cccs1)C(C)C 160543903 LXFWTKMRRBPKIQ-CYBMUJFWSA-N 253.411 3.479 70 20 CGID C[C@H](CC1CCCC1)C(=O)N(C)Cc1cccn1C 160725655 QBIHOOKVNJOKNR-CYBMUJFWSA-N 262.397 3.200 70 20 CGID CC[C@H](c1ccc(Cl)cc1)N(C)C[C@H](O)C1CC1 160847620 BNBMNBZDQGKYCD-CABCVRRESA-N 267.800 3.494 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](C)C2CCN(C)CC2)C1 159452577 OOBAOURJDGCMLB-NUEKZKHPSA-N 284.513 3.371 70 20 CGID C[C@@H](NCCC(C)(C)O)c1ncc(-c2ccccc2)o1 159885880 GRYIIYILWRYEQG-GFCCVEGCSA-N 274.364 3.153 70 20 CGID CCOc1ccc(N[C@H](C)CCn2cccn2)cc1OC 159379675 HNBYIWGKYBROKG-CYBMUJFWSA-N 289.379 3.181 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(C)n(CC)c1C 159577287 TUVZHTMGMCISSN-HIFRSBDPSA-N 262.397 3.433 70 20 CGID CCOc1ccc(CNC(=O)N2CCCCCC2)cc1 217300859 UJLQZHRSIVIZLM-UHFFFAOYSA-N 276.380 3.171 70 20 CGID C[C@@H](c1ccc(F)c(Cl)c1)S(=O)(=O)Cl 88251454 UEXPKYZDGFONPN-YFKPBYRVSA-N 257.113 3.109 70 20 CGID C[C@H](N(C)CC1CCN(C(=O)C(C)(C)C)CC1)C1(C)CC1 160097409 QDROGSXWEMHZFT-AWEZNQCLSA-N 294.483 3.392 70 20 CGID COCCCC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 160168603 CSPGKMLFVITKCV-GOSISDBHSA-N 298.386 3.022 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 160196889 BBXRYIZEZFNEPL-DMEJVMROSA-N 290.359 3.175 70 20 CGID CC(=O)c1c(F)cccc1N[C@@H]1CCO[C@H](C2CC2)C1 160412909 BWZAGASVOJMCNS-DOMZBBRYSA-N 277.339 3.398 70 20 CGID CCC(CC)n1nccc1C(=O)N(C)Cc1ccco1 160608793 RDVBJBXJHJWBOH-UHFFFAOYSA-N 275.352 3.109 70 20 CGID C[C@@H](CCn1cccn1)Nc1ccc2ncsc2c1 159419824 KIBVRBXHOMUSEG-NSHDSACASA-N 272.377 3.384 70 20 CGID c1ccc([C@@H](NCCOCC2CC2)c2nccs2)cc1 159822058 VARXBBJZMRAYFX-OAHLLOKOSA-N 288.416 3.249 70 20 CGID C[C@@H](c1cc2ccccc2o1)N(C)CCn1ccnc1 159688559 RPFZJVXRWPWTLQ-ZDUSSCGKSA-N 269.348 3.322 70 20 CGID CCCOc1cccc(CN2CCCC[C@H]2CCO)c1 159735471 LMXAQRBQJADNBI-INIZCTEOSA-N 277.408 3.212 70 20 CGID COC(=O)c1ccsc1NC(=O)C[C@@H]1CC[C@H](C)C1 159382891 LBDBFXCIOQOZSV-VHSXEESVSA-N 281.377 3.300 70 20 CGID Cc1ccc(-c2cc(C(=O)N(C)C)c3c(C)noc3n2)cc1 159575524 PPBBGSRSGKFRCR-UHFFFAOYSA-N 295.342 3.208 70 20 CGID O=C(CCC1CCCC1)CSc1nncs1 159987298 HGIGXNVXXVTCHW-UHFFFAOYSA-N 256.396 3.170 70 20 CGID CN1CCC[C@@H](CN[C@H](c2ccccc2)C2CC2)C1 217564241 LCVZKWSLHUBYLA-WMLDXEAASA-N 258.409 3.069 70 20 CGID Cc1cc(F)ccc1OCC(=O)NC1CCCCCC1 160719628 GDNLKHLSVOVVFL-UHFFFAOYSA-N 279.355 3.352 70 20 CGID COc1ccccc1[C@H](C)N[C@H]1CCC[C@H](N(C)C)C1 161055374 ARSNRRJLBKMKHQ-KKUMJFAQSA-N 276.424 3.219 70 20 CGID COC(=O)N1CCC[C@@H]1c1cccc(Br)c1 217246248 SHSJJZFOPTZLEC-LLVKDONJSA-N 284.153 3.352 70 20 CGID CCC(CC)(CC)NC(=O)NCC1(CCOC)CC1 161119333 ZGXCGDHFAVAXHJ-UHFFFAOYSA-N 270.417 3.071 70 20 CGID COc1cc(F)c(C(=O)N(C)c2ccccc2)cc1OC 161132852 ACMQYYCTPPITIE-UHFFFAOYSA-N 289.306 3.120 70 20 CGID CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)ncn1 161399758 KRTVGKNEWLWMCS-UHFFFAOYSA-N 295.795 3.162 70 20 CGID CCOc1cccc(NC(=O)N[C@H](C)C2CCC2)c1 161417466 SEJGNHMPZYRTIM-LLVKDONJSA-N 262.353 3.395 70 20 CGID CCN(Cc1ccccn1)Cc1c(C)nc2ccccn12 161437948 IQSXOOWZVAIURK-UHFFFAOYSA-N 280.375 3.060 70 20 CGID CC/C=C(/C)C(=O)NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 161456124 DSQTWDVLNHMXCO-BAECOXONSA-N 255.361 3.045 70 20 CGID CN(C(=O)CCc1ccsc1)c1ccc2c(c1)OCO2 160098079 APVDJLHJWBGCDV-UHFFFAOYSA-N 289.356 3.072 70 20 CGID CC[C@@H](NC(=O)C1(CC)CCC1)c1c(C)noc1C 160210375 RBHBPLQXLSTTCU-GFCCVEGCSA-N 264.369 3.439 70 20 CGID CCOC[C@@H]1CCN(C(=O)C[C@H]2CCCCC2(C)C)C1 160390762 SUCQXAOYNLYNTM-HUUCEWRRSA-N 281.440 3.478 70 20 CGID CC[C@H](NCc1ccccc1CN1CCOCC1)C(C)C 160478911 HHPBMCNIIOCXNG-SFHVURJKSA-N 290.451 3.043 70 20 CGID CCC(CC)n1nccc1C(=O)N1C[C@H](C)C[C@@H](C)C1 160519983 GIUNXWDYKJCKNE-CHWSQXEVSA-N 277.412 3.362 70 20 CGID COc1ccc(N(C)C(=O)c2cc(C)ccc2O)cc1F 159478903 MYLCCFRDDSQMRT-UHFFFAOYSA-N 289.306 3.125 70 20 CGID Cc1nc(C)c(CCNC(=O)[C@H](C)c2cccs2)s1 159503799 PXWGNMJIIHXZDM-SECBINFHSA-N 294.445 3.284 70 20 CGID CSCCCCC(=O)NCCc1cc2ccccc2[nH]1 159510974 NUPAMSMYGZSIID-UHFFFAOYSA-N 290.432 3.360 70 20 CGID CCC[C@@H](C)NC(=O)[C@@H](C)Nc1ccn(CCC(C)C)n1 159921298 RZBOILXSKLPYCQ-ZIAGYGMSSA-N 294.443 3.034 70 20 CGID CCc1noc(C)c1CNc1cc(NC(C)=O)ccc1C 159390687 MUKLWFLAQODEAD-UHFFFAOYSA-N 287.363 3.424 70 20 CGID CCN(CCNCc1ccc(C2CC2)cc1)C1CC1 217434815 RGJQPJAWNKOWEY-UHFFFAOYSA-N 258.409 3.138 70 20 CGID CC[C@@H](NC1CCC(c2ccccc2)CC1)C(=O)OC 159489134 WQXKKLCCAYSTBF-UYSNPLJNSA-N 275.392 3.254 70 20 CGID Cc1cccc(C)c1CN[C@@H]1CCN2CCC[C@@H]2C1 160387944 HVVQQOCDGZYIGP-HZPDHXFCSA-N 258.409 3.020 70 20 CGID Cc1cc(C)c(CNC2CCC3(CC2)OCCO3)c(C)c1 161376678 JEIVWHVWAIKOCA-UHFFFAOYSA-N 289.419 3.387 70 20 CGID CCc1ccc(CNCCc2ccc3c(c2)OCCO3)cc1 216725796 PAZAQXNULFTVBA-UHFFFAOYSA-N 297.398 3.353 70 20 CGID Cc1nc2c(n1CC(=O)c1ccc(F)c(F)c1)CCCC2 216679268 QEYTUMAYLCZCAU-UHFFFAOYSA-N 290.313 3.231 70 20 CGID CC1CCN(C(=O)N[C@H]2CCCC(C)(C)C2)CC1 160722217 IXSWVCMQIIYOIZ-ZDUSSCGKSA-N 252.402 3.397 70 20 CGID CCC(C)(C)CC(=O)Nc1cccc(S(=O)(=O)F)c1 809282606 PVJMACOELQLWHX-UHFFFAOYSA-N 287.356 3.110 70 20 CGID C[C@H]1CCCC[C@H]1CN[C@H](C)C(=O)OC(C)(C)C 217770229 ZXAAYTKMHIYGBC-XQQFMLRXSA-N 255.402 3.133 70 20 CGID CS[C@@H](C)CNC(=O)Nc1cccc(OC(F)F)c1 159890805 OLVBLMHTBNAPHC-QMMMGPOBSA-N 290.335 3.161 70 20 CGID CC(=O)Nc1ccc(C)c(NC(=O)N[C@H](C)C2CCC2)c1 161047778 AZIXWLFVPXILKT-LLVKDONJSA-N 289.379 3.264 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)Cc1cccc(Cl)c1 161413402 LVFYHABQWKMAOP-GHMZBOCLSA-N 251.757 3.282 70 20 CGID C[C@H](OCC1CC1)C(=O)N1CCc2c(Cl)cccc21 161477080 QBSMFLMHQFVDAJ-JTQLQIEISA-N 279.767 3.044 70 20 CGID C[C@H](C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccsc1 160235848 IOHKEAHNFZMWKJ-IINYFYTJSA-N 287.384 3.361 70 20 CGID CCCC1(CNC(=O)CSCc2ccncc2)CC1 160473703 OZDFVIQLAUXBIM-UHFFFAOYSA-N 278.421 3.011 70 20 CGID C[C@H]1CCCN(C(=O)N[C@@H](C)c2ccsc2)C1 160524704 SBXGHYSBUBAOQM-QWRGUYRKSA-N 252.383 3.251 70 20 CGID COc1cc(F)ccc1NC(=O)N[C@H](C)C1CCC1 160541526 KTJDILKYORYUPR-SECBINFHSA-N 266.316 3.144 70 20 CGID CCc1ccc([C@@H](C)NCc2nc(O)cc(CC)n2)cc1 160543078 DMUBMZQSZUXPIM-GFCCVEGCSA-N 285.391 3.158 70 20 CGID CC(C)[C@H](Cc1ccccc1)C(=O)NC1CC=CC1 160773087 AAQFBYAQCITJJV-INIZCTEOSA-N 257.377 3.336 70 20 CGID CN(Cc1cccn1C)C(=O)c1cc2ccccc2o1 160842121 HMCBWQDNLUFSPI-UHFFFAOYSA-N 268.316 3.044 70 20 CGID CCCCCC[C@@](C)(CC)C(=O)N1CCCNCC1 160851571 WPAYWKNDUSUICW-MRXNPFEDSA-N 268.445 3.195 70 20 CGID C[C@@H](C(=O)NCCCNc1ccccc1)c1ccsc1 159611718 MLSBPZPCLCSEOX-CYBMUJFWSA-N 288.416 3.470 70 20 CGID C[C@H]1CC[C@@H](C(=O)Nc2cc(CC3CCCCC3)n[nH]2)O1 159648573 NCVPIJKNWIIZMF-FZMZJTMJSA-N 291.395 3.039 70 20 CGID CCCc1noc(CCCC(=O)N[C@@H]2CCC[C@H]2CC)n1 159557307 MRTNTROEYAQGPO-CHWSQXEVSA-N 293.411 3.040 70 20 CGID CCCCOC(=O)[C@@H](C)N1CCC(OC2CCCC2)CC1 159977243 WDJJGQOAOBLVTN-CQSZACIVSA-N 297.439 3.142 70 20 CGID Cc1c(NCc2cc(F)cc(Cl)c2)cccc1C(N)=O 160854423 AIKBIZGELDWPGO-UHFFFAOYSA-N 292.741 3.499 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1 161111848 QXLNAJPHKDMFMR-MAZHCROVSA-N 264.388 3.349 70 20 CGID CCCn1nccc1CN[C@@H]1CCCc2ccccc21 159982350 WJONVPPRQHZCNU-QGZVFWFLSA-N 269.392 3.460 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CCn1cc(C)cn1 161267429 RQDMZTAFFNHIDY-GJZGRUSLSA-N 277.412 3.009 70 20 CGID C[C@@H](Cc1ccccc1Cl)C(=O)N1CCO[C@@H](C)[C@H]1C 160041864 JEFPSOPHFUNKII-XQQFMLRXSA-N 295.810 3.154 70 20 CGID CCCCn1ncc(C(=O)NCc2ccccc2C)c1C 160042924 BVOFPBOMPUGCMP-UHFFFAOYSA-N 285.391 3.230 70 20 CGID C[C@H](NC(=O)COc1ccc2[nH]ccc2c1)c1ccccc1 160044308 GEBWTCCSHSPGPA-ZDUSSCGKSA-N 294.354 3.424 70 20 CGID Cc1ccc(C(=O)NC2CC2)cc1NCc1ccco1 160239415 AKUWLSUUKCLTKT-UHFFFAOYSA-N 270.332 3.092 70 20 CGID CC(C)c1ccc(OCCN[C@@H](C)c2cnccn2)cc1 160333100 RCMRNSCAUSOIDE-AWEZNQCLSA-N 285.391 3.330 70 20 CGID COc1cc(NC(=O)CC2(CN)CCCCC2)ccc1F 160360435 DNNUSDHJQBJPEG-UHFFFAOYSA-N 294.370 3.072 70 20 CGID Cc1cccc2c1CC[C@H]2NC[C@H]1CCCC[C@@H]1O 160475906 SPVWKOPEAJEUIS-XYPHTWIQSA-N 259.393 3.123 70 20 CGID C[C@@H]1CN(c2nc(C(F)(F)F)cs2)CC(C)(C)O1 160492199 SLPQWFARZATPGQ-SSDOTTSWSA-N 280.315 3.166 70 20 CGID CC1(NC(=O)NCc2cc(-c3ccccc3)on2)CCC1 160551736 OGUPMOSTVPYUGK-UHFFFAOYSA-N 285.347 3.083 70 20 CGID C[C@@H]1CN(Cc2ncc(-c3ccccc3F)o2)CCS1 160582434 JZSCEUKDLNUSLZ-LLVKDONJSA-N 292.379 3.418 70 20 CGID CCC1(CNC(=O)Nc2ccnc(C)c2Cl)CC1 159651689 JTFRMXBAVMVBEO-UHFFFAOYSA-N 267.760 3.355 70 20 CGID C(=C/c1ccccc1)\CN[C@H]1[C@H]2CCO[C@@H]2C12CCC2 159481200 MLQNMOQZDIYCDP-AKIIIIIDSA-N 269.388 3.247 70 20 CGID Cc1nc(C)c(CCNC(=O)[C@H](C)c2ccsc2)s1 159504491 VLVAPROSYCOEIB-SECBINFHSA-N 294.445 3.284 70 20 CGID Cn1ccc(CNCc2ccc(Br)c(F)c2)c1 159537992 SLZUCHLOKQDORV-UHFFFAOYSA-N 297.171 3.217 70 20 CGID CCc1[nH]nc(NC(=O)c2cccc(Cl)c2F)c1C 159740756 DDGYYGDNFDRKGD-UHFFFAOYSA-N 281.718 3.325 70 20 CGID CN(C(=O)Nc1ccc(F)c(Cl)c1)[C@@H]1CCSC1 159391603 PZHVWAMAKIOJKH-SECBINFHSA-N 288.775 3.448 70 20 CGID CCO[C@@H]1C[C@@H](NCc2ccc(C)c(F)c2)C1(C)C 217892571 CGGOGFKMJAQDHU-HUUCEWRRSA-N 265.372 3.427 70 20 CGID OCC1(CNCc2ccc3ccccc3c2)CCCC1 160109091 DWYCMUOBDIESPM-UHFFFAOYSA-N 269.388 3.482 70 20 CGID CCCn1nccc1CNc1cccc(OCC)c1 160101508 GGCCYCRZYUHLRW-UHFFFAOYSA-N 259.353 3.304 70 20 CGID Cc1cc(CCCC(=O)N[C@H](CO)CC(C)C)c(C)s1 161265652 LCZZMRLZTKCGSS-HNNXBMFYSA-N 297.464 3.211 70 20 CGID CC(C)[C@@H](C)CC(=O)N(C)c1ccc2c(c1)OCO2 160086247 YBCOQIPDRBQOJK-NSHDSACASA-N 263.337 3.060 70 20 CGID CC[C@@H](NC(=O)Cc1cccc(C)c1)c1c(C)noc1C 160193183 INEDHGWQSRDISC-OAHLLOKOSA-N 286.375 3.410 70 20 CGID CCn1cc(NC(=O)C(C)(C)C2CCCC2)ccc1=O 160209406 GOUXKTYVKZBPEJ-UHFFFAOYSA-N 276.380 3.023 70 20 CGID Cc1ccc2oc(C(=O)NCCc3cccc(O)c3)cc2c1 160234365 KYFSXXWOBWWLNS-UHFFFAOYSA-N 295.338 3.419 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N1CCN(c2cccc(C)c2)CC1 160254745 IKCDWOVCOCOLMH-WMZOPIPTSA-N 286.419 3.080 70 20 CGID CC[C@H](OC1CCCCC1)C(=O)N(C)Cc1cccn1C 160590545 OZAKOUNYSRHZHC-INIZCTEOSA-N 292.423 3.111 70 20 CGID C[C@@H](NCC(C)(C)O)c1ccc(-c2ccccc2)o1 160651041 QQGSMMOMICYSBC-GFCCVEGCSA-N 259.349 3.368 70 20 CGID CC[C@@H](C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160751906 RWAKLNCXNVQUSX-OLZOCXBDSA-N 253.386 3.031 70 20 CGID Cc1cc(NC(=O)[C@H]2OCC[C@H]2C)c2cccnc2c1C 160794148 HUPFUGBNDRCNJT-HWPZZCPQSA-N 284.359 3.215 70 20 CGID Cc1cc(C)cc(Cn2cnc(C(C)C)cc2=O)c1 160832566 CTHFKTBAKZEBDC-UHFFFAOYSA-N 256.349 3.032 70 20 CGID C[C@H](OCC1CC1)C(=O)N[C@@H]1CCCc2sccc21 159839053 JUBNGAIVMKYORR-GXFFZTMASA-N 279.405 3.057 70 20 CGID CCCN(CCC)C(=O)CCC(=O)N[C@@H]1CCC[C@@H]1CC 159713236 GDQMIDVYPZPCEO-LSDHHAIUSA-N 296.455 3.110 70 20 CGID CCc1ccc(NC(=O)N(C)CCc2nccs2)cc1 159938175 UVZWGZXMLGWDOO-UHFFFAOYSA-N 289.404 3.412 70 20 CGID CCCCCC(=O)N[C@@H](CC)c1c(C)noc1C 159995597 RETFMADDSOBAHE-LBPRGKRZSA-N 252.358 3.439 70 20 CGID Fc1ccc(F)c(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159606293 HOAVZTVNKSFAQD-CFVMTHIKSA-N 279.330 3.012 70 20 CGID Cc1cc(NC(=O)NCC(F)(F)F)c2ccccc2n1 160324091 ZQJIKIQGSAVPAK-UHFFFAOYSA-N 283.253 3.227 70 20 CGID CCCN(C(=O)c1cccc(C)c1Cl)C1CCNCC1 160387725 LPAKTSOCGJGSAT-UHFFFAOYSA-N 294.826 3.253 70 20 CGID C[C@H]1C[C@H](C)CN(C[C@@H](O)c2cc3ccccc3o2)C1 216871272 YPEIIRPPCKKFLJ-KCQAQPDRSA-N 273.376 3.444 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(OC)cs1 159791946 HIPDWJOUCVZGTN-MWLCHTKSSA-N 253.367 3.065 70 20 CGID O=C(NC[C@H]1Cc2ccccc21)c1c(F)cc(F)cc1F 161046834 PZLQBURQPYPUSY-SNVBAGLBSA-N 291.272 3.174 70 20 CGID C[C@H](NCCSc1ccc(Cl)cc1)[C@H]1CCOC1 160052744 DACSURIMADVIPA-RYUDHWBXSA-N 285.840 3.447 70 20 CGID Cc1nscc1C(=O)N[C@@H]1CCCc2sccc21 160371305 BSZKAEPIPKQTPG-LLVKDONJSA-N 278.402 3.320 70 20 CGID CC(C)[C@@H](C)NC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 160375173 RBSLJXBQJDIUHX-DOMZBBRYSA-N 292.379 3.020 70 20 CGID C[C@H](NCC(C)(C)O)c1ccc(-c2ccccc2)o1 160650918 QQGSMMOMICYSBC-LBPRGKRZSA-N 259.349 3.368 70 20 CGID O=C(C1CCCCC1)N1CCc2c(F)cccc2C1 160916314 CSIHWCPYWMGARB-UHFFFAOYSA-N 261.340 3.291 70 20 CGID Cc1nnc(-c2cccc(N[C@@H](C)CCn3cccn3)c2)o1 159464614 OFRRZENVOZHNES-LBPRGKRZSA-N 297.362 3.132 70 20 CGID CC[C@H](N[C@H]1CCCSC1)c1ccc2c(c1)OCCO2 159556776 YGBSUAIOLFGNOK-KBPBESRZSA-N 293.432 3.394 70 20 CGID C[C@H](c1cccc(F)c1)N(C)CCOCC1CC1 159768525 NHYOPQNDOHSOLS-GFCCVEGCSA-N 251.345 3.245 70 20 CGID CCC[C@@H](O)CNC(=O)CCC(C)(C)c1ccccc1 159393599 WWHGQFKWMSZMGR-OAHLLOKOSA-N 277.408 3.022 70 20 CGID CCOc1cc2c(cc1CN[C@@H]1CCSC1)O[C@@H](C)C2 218606408 UQZHDFVWEFLYFG-SMDDNHRTSA-N 293.432 3.004 70 20 CGID Cc1cccc(CCNC(=O)Nc2cc(Cl)ccn2)c1 217415184 VMLJRIONWNBFTM-UHFFFAOYSA-N 289.766 3.408 70 20 CGID C[C@@H]1CN(Cc2noc(C3CCCCC3)n2)CCS1 159842529 PZFWOLISIWUALG-LLVKDONJSA-N 281.425 3.055 70 20 CGID CCCC[C@H](C)C(=O)Nc1cccc(S(=O)(=O)F)c1 799987679 GAXSUPGSONUHLB-JTQLQIEISA-N 287.356 3.110 70 20 CGID CC[C@H]1CCCN(C(C)(C)CN[C@@H](C)C2CCOCC2)C1 161026867 LOMOWIFEAYZLBE-HOTGVXAUSA-N 296.499 3.292 70 20 CGID C[C@H](C(=O)N[C@H]1CCOC2(CCCC2)C1)c1ccsc1 160256575 NWKTZVPHGQZAJO-JSGCOSHPSA-N 293.432 3.460 70 20 CGID Cc1cn(-c2ccccc2)nc1NC(=O)NC1CC=CC1 160309673 VOOMVFYJFVKKPX-UHFFFAOYSA-N 282.347 3.021 70 20 CGID CC1CCC(N(C)C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)CC1 160505339 RIEDYSPEGRQWBD-UHDQLFAASA-N 294.439 3.164 70 20 CGID O=C(CCc1ccoc1)N[C@H]1CCOC2(CCCCC2)C1 160943335 NLQNJMRFHFXHRD-HNNXBMFYSA-N 291.391 3.210 70 20 CGID CC[C@H](C)CN(CC)C(=O)Nc1cc(C(=O)OC)cs1 160968088 AJMXTDKLNACHGW-JTQLQIEISA-N 298.408 3.435 70 20 CGID COc1ccc(N(C)C(=O)Cc2ccc(C)cc2)cc1F 159689665 ZOWXXYTXZJMUMV-UHFFFAOYSA-N 287.334 3.348 70 20 CGID COc1cccc(Cl)c1CC(=O)N[C@@H](C)CC1CC1 159957914 QBOZNSABUPAHJX-JTQLQIEISA-N 281.783 3.196 70 20 CGID C[C@H](NC(=O)C1CCC(C)(C)CC1)C1CCOCC1 159376080 NTGVVANOPMSGQR-LBPRGKRZSA-N 267.413 3.134 70 20 CGID CCCCn1ncc(NC(=O)N(CC)C(C)C)c1C 159964630 FTFDJGDMMIYGPT-UHFFFAOYSA-N 266.389 3.254 70 20 CGID Cc1nn(C)cc1CN[C@H](c1ccccc1)c1ccccn1 159586797 XYCHKMURCPIEDO-GOSISDBHSA-N 292.386 3.003 70 20 CGID COc1cc(CNc2ccc(F)c(OC)c2)cc(OC)c1 159988999 HIARWLKOVBNMJU-UHFFFAOYSA-N 291.322 3.464 70 20 CGID Cc1ccccc1C[C@H](C)NC[C@H]1CCCC[C@@H]1O 160569528 VOALWFNMCUFDAN-UAGQMJEPSA-N 261.409 3.067 70 20 CGID CC1(O)CCN(C(=O)c2cc3cc(F)ccc3s2)CC1 161297697 SEDLRFYQQBFBIR-UHFFFAOYSA-N 293.363 3.027 70 20 CGID CCOc1ccc(CNC(=O)NCc2ccc(C)cc2)cc1 217300835 AGVAPENEOPQLBQ-UHFFFAOYSA-N 298.386 3.393 70 20 CGID COc1ccc(C)cc1[C@H](C)N[C@@H]1CCN2CCCC[C@@H]12 217677649 LPIUWFRFLIXYKC-UAGQMJEPSA-N 288.435 3.281 70 20 CGID O[C@H](CNC1C2CC3CC(C2)CC1C3)c1ccc(F)cc1 218255349 HMHCIPGMRTWYJF-CANBTALTSA-N 289.394 3.273 70 20 CGID CC[C@H](NC[C@@H](C)N(C)Cc1ccccc1)C1CC1 160888924 JHPLEEQHNDTLCK-PBHICJAKSA-N 260.425 3.285 70 20 CGID CCO[C@@H](C)c1nccn1Cc1cc(-c2ccco2)on1 161469910 RIGRUJFOGRVIET-NSHDSACASA-N 287.319 3.277 70 20 CGID Cc1cscc1C(=O)N[C@H]1CCOC2(CCCC2)C1 160012816 HFCNOSQMNNPWJV-LBPRGKRZSA-N 279.405 3.278 70 20 CGID CC[C@@H](NC(=O)c1c(F)cccc1F)c1c(C)noc1C 160332324 QMPWMBIXDAMGGM-GFCCVEGCSA-N 294.301 3.451 70 20 CGID C[C@@H](CC(=O)N[C@@H]1CCCc2occc21)c1ccncc1 160531345 GPTVZYXKXAYRSD-SWLSCSKDSA-N 284.359 3.362 70 20 CGID Cc1csc(CNC(=O)[C@H]2C[C@H]2c2sccc2C)n1 160617951 PSHNPCHFWILVPO-MNOVXSKESA-N 292.429 3.241 70 20 CGID CCCn1c(C)nnc1CN1CC[C@H](c2ccccc2)[C@@H]1C 160911759 MBXCMGGBINHDMM-YOEHRIQHSA-N 298.434 3.375 70 20 CGID CC(C)(C)c1nsc(N2C[C@@H]3CCC[C@H]3C2)n1 159938784 JWEMEMCBMXFDOX-UWVGGRQHSA-N 251.399 3.072 70 20 CGID CCC(CC)(CC)CNC(=O)N1CCC[C@@H]1COC 159677405 FCJNUAGSTVHJGT-CYBMUJFWSA-N 270.417 3.023 70 20 CGID CCOCCC(=O)N1C[C@@H](C)CSc2ccccc21 159710940 DWSCVTHGLZGNNZ-GFCCVEGCSA-N 279.405 3.188 70 20 CGID CCOCCC1(CN[C@@H](C)c2ccncc2)CCC1 159968045 MLNDTXXCWTUMQT-AWEZNQCLSA-N 262.397 3.329 70 20 CGID CCc1nc(CN[C@H](CC)c2cccc(Cl)c2)n[nH]1 160298403 WXBKDFFXFGTLEK-GFCCVEGCSA-N 278.787 3.261 70 20 CGID COc1ccc([C@@H](C)NC(=O)NCc2cccs2)cc1 217301406 XZMVTXZJTGXTBI-LLVKDONJSA-N 290.388 3.317 70 20 CGID CC[C@@H](NC(=O)c1cc(Cl)c[nH]1)c1c(C)noc1C 160327308 AHFVVVCRQMFPHJ-SNVBAGLBSA-N 281.743 3.154 70 20 CGID CCSc1cc(Cl)ccc1C(=O)NCC(F)F 160636535 ZBHQMPLHNCAZCZ-UHFFFAOYSA-N 279.739 3.447 70 20 CGID C[C@H](C(=O)NCCc1ccccc1)c1c(F)cccc1F 160633270 QOFGASMVFGSADF-LBPRGKRZSA-N 289.325 3.427 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H](COC)C2CC2)C1 159458536 ZGGNZTPAMCPIEG-MCIONIFRSA-N 257.443 3.065 70 20 CGID C[C@](O)(CN[C@H]1CCc2ccccc21)c1ccsc1 159932552 GTBVZLJXFDFIKW-HOTGVXAUSA-N 273.401 3.233 70 20 CGID C[C@H](SCCN1CCOCC1)c1cccc(Cl)c1 159935909 BKBWGHDEONIXQO-LBPRGKRZSA-N 285.840 3.466 70 20 CGID CC(C)CO[C@@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159959376 IRDRFTUCJSJQDJ-LLVKDONJSA-N 283.441 3.087 70 20 CGID Cc1csc(C(C)(C)NC(=O)CCCn2cccc2)n1 159573594 HTHDUJFZWOVGJT-UHFFFAOYSA-N 291.420 3.085 70 20 CGID CN(Cc1csc(C2CCCC2)n1)C[C@H]1CCC[C@@H]1O 159696011 CYFYVARMUUHJIW-HIFRSBDPSA-N 294.464 3.394 70 20 CGID CC1CCN(CCNCc2cc(F)cc(Cl)c2)CC1 160912174 UFADSIQHOVAGCC-UHFFFAOYSA-N 284.806 3.301 70 20 CGID CCC(C)(C)OCC[C@H](C)CCS(=O)(=O)Cl 116049673 MCUIWDGNWZAPIL-JTQLQIEISA-N 270.822 3.177 70 20 CGID Clc1ccc(CSc2ncnc3[nH]cnc23)s1 161375421 QDEIFTNKVYPSGB-UHFFFAOYSA-N 282.781 3.360 70 20 CGID C[C@H]1CC(NC(=O)Nc2cccc3[nH]ccc23)C[C@H](C)O1 160215602 XASGNNCYXVQUBX-QWRGUYRKSA-N 287.363 3.245 70 20 CGID C[C@H](Cc1cccs1)NC(=O)N1CCC2(CCC2)C1 160413102 FWQIDECFSYGKFB-GFCCVEGCSA-N 278.421 3.265 70 20 CGID CCCC1(CNC(=O)[C@](C)(O)[C@H](C)c2ccccc2)CC1 160681963 DAJKOYUTLRKUSZ-RHSMWYFYSA-N 289.419 3.238 70 20 CGID C/C=C(\C=C\C(=O)NCCc1csc(CC)n1)CC 160741399 ASXQTDGJABGQEA-JVKQVXOYSA-N 278.421 3.277 70 20 CGID CCc1ccc([C@@H]2CCCCCN2C(=O)NCCOC)o1 160807830 VGOCXHCVDOUFDL-AWEZNQCLSA-N 294.395 3.115 70 20 CGID O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)C1CC=CC1 159490483 ZTEHVDIHMUTVFB-WMLDXEAASA-N 285.387 3.237 70 20 CGID CCCc1nc(CN2CCC[C@@H]2c2cccc(C)n2)no1 159789282 QFMKRXOMDMPLOI-CQSZACIVSA-N 286.379 3.063 70 20 CGID CC[C@@H]1C[C@@H](N[C@H](C)c2ccc(OC)cc2)CCO1 160086317 BDNIPWZKBZDBLZ-VHDGCEQUSA-N 263.381 3.303 70 20 CGID CC(C)CONC(=O)Nc1cc(F)cc(Cl)c1 161077786 YEKMJMXETXMTFN-UHFFFAOYSA-N 260.696 3.188 70 20 CGID CC(C)C[C@H](C)NC(=O)c1csc([C@H]2CCCO2)n1 161353623 ZILDEYNVVHXQLN-CMPLNLGQSA-N 282.409 3.159 70 20 CGID CC[C@@H](S[C@@H](C)C(=O)N(C)C)c1ccc(F)cc1 161355397 WUWAAHYNALNLRY-GXFFZTMASA-N 269.385 3.487 70 20 CGID CCN(CCOCC1CC1)Cc1c(F)cccc1F 160180416 MQEQPWXOEKOUAV-UHFFFAOYSA-N 269.335 3.213 70 20 CGID C[C@@H](NCc1nnc(-c2ccccc2)s1)c1cccnc1 160731126 DIHAHGFBAGDXRK-GFCCVEGCSA-N 296.399 3.451 70 20 CGID COc1cccc(NCc2cccc3cccnc23)n1 159484551 WBGVZRUNFYOFAQ-UHFFFAOYSA-N 265.316 3.251 70 20 CGID C[C@H](N[C@H](C)C1CC1)c1cnn(Cc2ccccc2)c1 160137167 QIVCIKOLBWHXHU-KGLIPLIRSA-N 269.392 3.381 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCc2ccc(F)cc21 160112193 FERMXAPMNNCQQN-BLLLJJGKSA-N 264.388 3.133 70 20 CGID COc1ccccc1CN(C)C(=O)N1CCCCCC1 160389074 WVOYBBXFKNRZLP-UHFFFAOYSA-N 276.380 3.123 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c(F)c1 161035297 WJUPYKQVDGRYDQ-DOMZBBRYSA-N 292.354 3.213 70 20 CGID C[C@H]1CC[C@@H](C)N1c1ncnc2c1cnn2-c1ccccc1 161443062 PQTKGBCTPMZGIN-BETUJISGSA-N 293.374 3.193 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)CC2C[C@@H]3CC[C@H](C2)N3)C1 161474099 YLIKYHWCXPLZIQ-XYTVBORESA-N 292.467 3.192 70 20 CGID CC[C@H]1CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1 160079570 NSUPXSRMAMVACT-LBPRGKRZSA-N 288.366 3.498 70 20 CGID CC[C@H](CC(=O)NC[C@H]1CCCN1C)c1ccc(C)cc1 160130552 GCNNKGGWKZXYNK-NVXWUHKLSA-N 288.435 3.089 70 20 CGID CCc1ccc([C@@H](C)NC[C@](C)(O)c2ccsc2)o1 160136679 KDJNLKJCEMDYQD-ABAIWWIYSA-N 279.405 3.462 70 20 CGID CCCOc1cccc(C(=O)NCCc2cccc(O)c2)c1 160195117 IFNJRZDIQYRYBU-UHFFFAOYSA-N 299.370 3.154 70 20 CGID C[C@@H]1CCC[C@@H](C)N1C(=O)Cc1cc(F)c(F)cc1F 160222505 MVUKGURKYDZCTC-NXEZZACHSA-N 285.309 3.436 70 20 CGID CCN(C)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 160500507 IAGQTTAYPZTOSD-HUUCEWRRSA-N 260.381 3.059 70 20 CGID CN[C@H]1CCN(C(=O)C[C@@H](C)c2ccc(C(C)C)cc2)C1 160538040 YSJMTDDVYQKWHO-PBHICJAKSA-N 288.435 3.124 70 20 CGID CCCCS[C@@H](C)C(=O)Nc1cccc(F)n1 160582903 YXTSBJMTNKEGCP-VIFPVBQESA-N 256.346 3.081 70 20 CGID CC(C)c1ncc(C(=O)Nc2cccc(F)n2)s1 160589458 ZOJLJTDFDOZQTP-UHFFFAOYSA-N 265.313 3.053 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1c1nc(-c2ccc(F)c(F)c2)no1 160996871 JYCMEZLOVRPXLN-KCJUWKMLSA-N 292.285 3.488 70 20 CGID CCc1ccc([C@H](C)CC(=O)N[C@@H](CO)CC(C)C)cc1 160990222 QJNLYMGBMPYKHA-RHSMWYFYSA-N 291.435 3.266 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(C)n(C(C)(C)C)n1 159810976 WTTMREVVCJEQEC-CHWSQXEVSA-N 277.412 3.255 70 20 CGID Cc1ccsc1C(=O)N[C@@H]1CCOC2(CCCC2)C1 159923019 RBYVVCAUEHCKEQ-GFCCVEGCSA-N 279.405 3.278 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)N1CCC[C@@H]1c1ccccc1 159541453 PWFMAUAAMDKFHD-XOKHGSTOSA-N 285.387 3.355 70 20 CGID CC1(C)C[C@H](NCc2csc(C(C)(C)C)n2)CCO1 159779125 CJFZKPIMYUUQIG-LLVKDONJSA-N 282.453 3.488 70 20 CGID Cc1cccc2c1CC[C@@H]2NC[C@H]1CCCC[C@@H]1O 160475752 SPVWKOPEAJEUIS-COXVUDFISA-N 259.393 3.123 70 20 CGID COc1ccc([C@@H](C)N[C@H]2CCC[C@H](N(C)C)C2)cc1 161112660 RSAOBSSNCRNSLX-KBMXLJTQSA-N 276.424 3.219 70 20 CGID CCCCCOCCCCCCS(=O)(=O)Cl 112155465 HLKPMSGYHLKPFZ-UHFFFAOYSA-N 270.822 3.322 70 20 CGID C[C@H](CO)SCc1ccc(Br)cc1F 160761523 RBXWOTUHLHUHIS-SSDOTTSWSA-N 279.174 3.202 70 20 CGID C[C@@H]1CCC[C@H](CCNC(=O)N(C)C[C@@H]2CCC[C@@H]2O)C1 161304555 GAVZFQXHBBCION-WCVJEAGWSA-N 296.455 3.005 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccc2ccccc2c1O 160366262 XYFHDJZVDBNIDD-UHFFFAOYSA-N 294.354 3.156 70 20 CGID CC[C@H](c1ccncc1)N(CC)C(=O)NCC(C)C 160829294 VFIZMOONFVUUHE-CQSZACIVSA-N 263.385 3.220 70 20 CGID COc1cccc([C@@H](C)C(=O)NCC2(C3CC3)CC2)c1 159800503 FQSMERWYSBHYBN-GFCCVEGCSA-N 273.376 3.105 70 20 CGID CCCCCN(c1ccc(C(C)=O)cc1)S(=O)(=O)CC 159666301 RHYDOHZUXCMONJ-UHFFFAOYSA-N 297.420 3.236 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(C)cc1C 159737275 ZRXADFCLVOGMAD-UHFFFAOYSA-N 278.396 3.224 70 20 CGID CC(C)[C@@H](O)CNC(=O)C1CCC(c2ccccc2)CC1 159748665 VHYGRWDLRNOCLX-JCYILVPMSA-N 289.419 3.094 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)Cc1ccc(OC)cc1 159396002 PUDGQIYJGWEUCA-GDBMZVCRSA-N 261.365 3.090 70 20 CGID C[C@H](NC(=O)c1ccc2ccccc2c1O)C1CCC1 160224145 YYPSMEUJVIHQEU-NSHDSACASA-N 269.344 3.464 70 20 CGID COc1cc(CNCc2cc(F)cc(Cl)c2)ccn1 160934947 LDRZPSRXGQMJNW-UHFFFAOYSA-N 280.730 3.173 70 20 CGID N[C@H](CC(=O)N1CCC[C@@H]2CCCC[C@H]21)c1ccccc1 218011585 CLIQTFBCHMYLNE-GVDBMIGSSA-N 286.419 3.258 70 20 CGID CCc1cccc(OCCOc2cc(C)ccc2C(N)=O)c1 217592987 ZKNYTCOFWPELBH-UHFFFAOYSA-N 299.370 3.114 70 20 CGID CC(C)C[C@@H](CO)NC(=O)C[C@@H](c1ccccc1)C(C)C 161202731 NRPPFQMHGSWWCM-DLBZAZTESA-N 291.435 3.340 70 20 CGID C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)C1CCCCC1 161224892 PCKDTWYERCQEOO-LBPRGKRZSA-N 291.366 3.484 70 20 CGID CCCn1c(C)nnc1Cn1cnc2cc(C)c(C)cc21 161226899 GJTRJEBNDIEKOI-UHFFFAOYSA-N 283.379 3.011 70 20 CGID CCCCC(=O)N1CCC[C@@H]1c1ccc(COC)o1 161349942 CXVAACFGTXOARM-CYBMUJFWSA-N 265.353 3.280 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)CC(C)C)c2C)o1 161441817 QSMCCECXRDUBBY-UHFFFAOYSA-N 261.325 3.271 70 20 CGID COc1ccc(Cl)cc1C(=O)NCC1(C2CC2)CC1 160070130 LSPNVIPXZIROCP-UHFFFAOYSA-N 279.767 3.269 70 20 CGID CC(C)(C)CC(C)(C)NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 160280892 JJBOVQSPLZQHCY-ZIAGYGMSSA-N 296.455 3.458 70 20 CGID CC[C@H](C)OCC(=O)N[C@H](C)c1c(F)cccc1Cl 160442133 XWNWBCBSIYOAGU-VHSXEESVSA-N 287.762 3.471 70 20 CGID Cc1ccc(C)c(C(=O)N(C)c2ccc3c(c2)OCO3)c1 160539551 LTWRMUSQFWDGGK-UHFFFAOYSA-N 283.327 3.309 70 20 CGID CCc1ccc([C@H](CO)NC[C@H]2CC=CCC2)cc1 160766661 APCRQXJFFRCBDP-RDJZCZTQSA-N 259.393 3.228 70 20 CGID CCn1ccnc1CN(Cc1ccc(F)cc1F)C1CC1 160810263 FBGDTUFAJHNLPQ-UHFFFAOYSA-N 291.345 3.346 70 20 CGID CCOc1ccccc1NC(=O)N[C@H](C)C1CCC1 159456238 GSFFHBXPJGBUAR-LLVKDONJSA-N 262.353 3.395 70 20 CGID Fc1ccc(Cc2nnc(N3CCCCC3)s2)cc1 159501526 JGERWHZMGHTFDM-UHFFFAOYSA-N 277.368 3.258 70 20 CGID C[C@@H](NC(=O)c1cc(F)cc(Cl)c1O)c1cccnc1 159544152 GSTTZQYNFFKFCD-MRVPVSSYSA-N 294.713 3.071 70 20 CGID CCOc1ccc(C(=O)NCC2(C3CC3)CC2)cc1 159775253 IOPHCVNIYOYZIQ-UHFFFAOYSA-N 259.349 3.005 70 20 CGID COc1ccc(OC)c([C@H](O)CN2[C@@H](C)CCC[C@@H]2C)c1 216888086 CINIZUCODDSNLD-HEHGZKQESA-N 293.407 3.000 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)Cc1ccc(F)cc1 160111641 QYCIOMHYPJIESW-KBPBESRZSA-N 266.404 3.077 70 20 CGID Cc1ccccc1S(=O)(=O)Nc1ccc(Cl)cc1O 160401409 NWGRWXCOGLHOLA-UHFFFAOYSA-N 297.763 3.155 70 20 CGID CC[C@@H](NC1CCN(C2CCCC2)CC1)C1CC1 160506006 IGTDIQQITRRAMC-MRXNPFEDSA-N 250.430 3.172 70 20 CGID C[C@H](CNCc1coc2ccccc12)N1CCCCC1 161094988 FWJKNZQSIDVQKS-CQSZACIVSA-N 272.392 3.397 70 20 CGID CCc1ncnc(NC[C@]2(N(C)C)CCC[C@H](C)C2)c1F 217985944 BZGIEPJTRBWKCC-LRDDRELGSA-N 294.418 3.101 70 20 CGID CCC[C@]1(C)CCCN(C(=O)NCC2(CCOC)CC2)C1 161072505 MROPKOJPTRJECO-MRXNPFEDSA-N 296.455 3.415 70 20 CGID CCCCn1ncc(NC(=O)N2CCC[C@H](C)C2)c1C 160005541 WEGNPAQUFUUPIH-LBPRGKRZSA-N 278.400 3.255 70 20 CGID CC[C@@H]1CCCC[C@H]1NC(=O)c1cccc(-c2ncn[nH]2)c1 160258059 WEDABHOVPYDMLR-IUODEOHRSA-N 298.390 3.170 70 20 CGID FC(F)Oc1ccc(N[C@@H]2CCO[C@@H](C3CC3)C2)nc1 160275122 PFTRUODOCFKIAN-ZYHUDNBSSA-N 284.306 3.053 70 20 CGID CSC[C@H](CCO)N[C@H](Cc1ccc(F)cc1)C(C)C 160279047 GEWWQTLFNJEYHO-JKSUJKDBSA-N 299.455 3.096 70 20 CGID CCc1cc(NC(=O)N2C[C@@H](C)[C@H]2c2ccccc2)n(C)n1 160424388 NHLAUFLFMTUQQH-WBMJQRKESA-N 298.390 3.207 70 20 CGID Cc1nc2ccccn2c1CN(C(C)C)C1CCOCC1 160566525 HTYPNEGKZZDDHL-UHFFFAOYSA-N 287.407 3.032 70 20 CGID CCCCCOCC(=O)Nc1cccc(OCCF)c1 160593851 SVIFOTBFOLZBAI-UHFFFAOYSA-N 283.343 3.180 70 20 CGID CC[C@@H](NC(=O)[C@@H](C)OCCC(C)C)c1c(C)noc1C 160600453 BZHUAHZQWXJQLQ-ZIAGYGMSSA-N 296.411 3.310 70 20 CGID C[C@@H](NCC(C)(C)O)[C@@H](C)c1nc2ccccc2s1 160621018 WVLZAICZGAWCSA-GHMZBOCLSA-N 278.421 3.149 70 20 CGID CCCc1cc(C(=O)N[C@@H](C)CC(=O)OCC)sc1C 160668043 YSZOFLXUYHRTNU-JTQLQIEISA-N 297.420 3.081 70 20 CGID COc1ccccc1SCc1nc(C2CC2)no1 160820114 BIMKLFPBLGBQHO-UHFFFAOYSA-N 262.334 3.248 70 20 CGID CC(C)c1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cn1 160932432 WGJRQNZTKBNICU-CHWSQXEVSA-N 260.381 3.323 70 20 CGID C[C@@H](C(=O)Nc1nccs1)c1c(F)cccc1F 160960768 XUMQYKFKXQANCK-SSDOTTSWSA-N 268.288 3.164 70 20 CGID CC[C@H]1CCN(C(=O)c2cn(C)nc2-c2cccs2)C1 159429634 BMCCQVOMNGPEDD-NSHDSACASA-N 289.404 3.021 70 20 CGID COc1ccc(C)cc1CN[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 159640249 SRYSPERWAHAZIN-XIRDDKMYSA-N 287.403 3.051 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(Br)cn1 159878399 FSCLVZLNEIKKDG-CABZTGNLSA-N 283.169 3.219 70 20 CGID CC1(C)CCC(C(=O)NCc2nccn2C(F)F)CC1 159686913 REXOKGOPEYHWFR-UHFFFAOYSA-N 285.338 3.111 70 20 CGID CCCN(CC)CCN[C@H]1CCCc2ccc(O)cc21 217667265 LVOMQGVXOSQHNP-KRWDZBQOSA-N 276.424 3.091 70 20 CGID C[C@@H](NC1CCN(C2CCCC2)CC1)C1(C)CC1 160498910 BLZSUZAIAFJVRU-CYBMUJFWSA-N 250.430 3.172 70 20 CGID CC(C)CCS(=O)(=O)NCC(C)(C)Cc1ccccc1 217229335 NOZNIASVTDHBFK-UHFFFAOYSA-N 297.464 3.221 70 20 CGID CCCCN(C)C(=O)NCc1ccc(OCC)cc1 217300940 YYXPHJBHFHHADL-UHFFFAOYSA-N 264.369 3.027 70 20 CGID COc1ccc(F)cc1[C@H](C)NC(=O)C[C@@H](C)SC 160083346 PGOPFCQPWJJYHD-ZJUUUORDSA-N 285.384 3.153 70 20 CGID Cc1ccc(OCCCC(=O)NCC2(C3CC3)CC2)cc1 160154615 DUXZGWNLOZJLTG-UHFFFAOYSA-N 287.403 3.460 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 160164729 QYRAHICTRDCAHN-RHSMWYFYSA-N 286.375 3.188 70 20 CGID C[C@@H](NC[C@@H](C1CCCCC1)N(C)C)c1ccco1 160415674 KDDYVOPJAXXMKB-HIFRSBDPSA-N 264.413 3.441 70 20 CGID CCc1nc(CNC(C)(C)c2cccc(Cl)c2)n[nH]1 160450204 HIQKFMSMLUHLKX-UHFFFAOYSA-N 278.787 3.045 70 20 CGID CC(C)Oc1cncc(C(=O)N(C)c2ccccc2F)c1 160477116 WSYSDRAPHLSCSC-UHFFFAOYSA-N 288.322 3.285 70 20 CGID Cc1cccc(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)c1C 160663813 DESXVIZVBZHALJ-HNNXBMFYSA-N 292.423 3.468 70 20 CGID CC(C)Sc1ccccc1NC(=O)[C@H](C)N(C)C 160888788 AVMHBQDLVGOJBK-NSHDSACASA-N 266.410 3.076 70 20 CGID CCOc1cc(C)ccc1NC(=O)CO[C@@H](C)CC 159464272 OJPYXAWNYCHONH-LBPRGKRZSA-N 265.353 3.147 70 20 CGID C[C@@H](Sc1ccncc1)C(=O)N(C)c1ccccc1 159869763 IUTNTSROIGEEBJ-GFCCVEGCSA-N 272.373 3.225 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(CCOC)Cc1ccccc1 159474840 IFRLTPHDHVIXBS-WBVHZDCISA-N 275.392 3.098 70 20 CGID C[C@@H](Cc1cccc(Cl)c1)C(=O)N[C@@H](C)C1CC1 159701829 WFOSXBQCSZVCLY-QWRGUYRKSA-N 265.784 3.433 70 20 CGID C[C@@H](CN[C@H](C)c1cncc(F)c1)N1CCc2ccccc21 159931150 VWKAXVVKHJLULF-UONOGXRCSA-N 299.393 3.323 70 20 CGID Cc1ccc(OCCCCS(=O)(=O)Cl)c(C)c1 100495555 NOWIUJGTAFTORY-UHFFFAOYSA-N 276.785 3.031 70 20 CGID CCSCC[C@@H](C)NC[C@@H](O)c1ccc(F)cc1F 160170773 HVWJAMWFELQGRO-QMTHXVAHSA-N 289.391 3.120 70 20 CGID CC1CCN(C(=O)N2CCC[C@H]3CCCC[C@H]32)CC1 160373729 UMCMLVCOJAZTOX-HUUCEWRRSA-N 264.413 3.493 70 20 CGID COC(=O)C1(NCc2c(F)cccc2Cl)CCCCC1 217095403 WWEDSEXGNPFOKD-UHFFFAOYSA-N 299.773 3.445 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cc(Cl)c2c(c1)OCO2 161424818 FEFCAYBYMUQMLC-IUCAKERBSA-N 281.739 3.082 70 20 CGID CC1(C)Cc2cccc([C@@H]3NC(=O)c4ccccc4N3)c2O1 161436220 LIUBYYHVMQWXSL-INIZCTEOSA-N 294.354 3.254 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cnc(-c2ccccn2)s1 161485942 AFVWEXYODSKUOD-GHMZBOCLSA-N 287.388 3.218 70 20 CGID C[C@@H](Nc1ccc2oc(N(C)C)nc2c1)c1cccnc1 160042486 OYRXCVZVPDCOCO-LLVKDONJSA-N 282.347 3.462 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1cscc1C 160113142 CMHVBTTYHBBZTR-AWEZNQCLSA-N 287.384 3.482 70 20 CGID Cc1cc2c(N[C@@H]3CCO[C@H](C4CC4)C3)ncnc2s1 160357439 NYBVFAQSLXWOFC-YPMHNXCESA-N 289.404 3.369 70 20 CGID COCC[C@H](C)NCCc1csc(-c2ccccc2)n1 160388254 WIJRPKPEKXNWDE-ZDUSSCGKSA-N 290.432 3.367 70 20 CGID CC[C@H](NC(=O)CCc1ccccc1)c1c(C)noc1C 160582236 TZTBBWSYZKEBSZ-HNNXBMFYSA-N 286.375 3.492 70 20 CGID C[C@H](N[C@H](CCCO)c1ccccc1)c1cncs1 160752077 BAGDKMHAHUFTMW-GXTWGEPZSA-N 276.405 3.308 70 20 CGID O=C(N[C@@H](C[C@@H]1CCOC1)c1ccccc1)C1CC=CC1 159490587 ZTEHVDIHMUTVFB-YOEHRIQHSA-N 285.387 3.237 70 20 CGID CCn1cc(NC(=O)C2CCC(C)(C)CC2)ccc1=O 159927276 DQMMHUXFNLQINQ-UHFFFAOYSA-N 276.380 3.023 70 20 CGID CCOC(=O)[C@H](NCC1CCCCC1)c1ccccc1 217674933 GIEQGNRYHAIYEM-MRXNPFEDSA-N 275.392 3.461 70 20 CGID CCC[C@](C)(O)CNCc1cccc2c1OC(C)(C)C2 217805762 AQWZEFCTOUCRAN-KRWDZBQOSA-N 277.408 3.041 70 20 CGID CCCn1nccc1CNc1cc(OC)ccc1F 160177691 XKZPNWWUQRYLKR-UHFFFAOYSA-N 263.316 3.053 70 20 CGID Fc1cc(Cl)cc(CNCCCCn2ccnc2)c1 160922972 PGHKZRVILFDQOJ-UHFFFAOYSA-N 281.762 3.246 70 20 CGID CCC(CC)n1nccc1C(=O)NC1CCCCC1 161136736 AIRZXCPVEVRQMX-UHFFFAOYSA-N 263.385 3.307 70 20 CGID CCC[C@H](C)NC(=O)[C@@H](C)SCc1c(CC)noc1C 160040810 BFJPXAQTQNELQV-CMPLNLGQSA-N 298.452 3.472 70 20 CGID O=C(/C=C/c1cccnc1)N[C@H]1CCCc2sccc21 160457190 HNJZODGRLQVLCB-UZYOAWRESA-N 284.384 3.350 70 20 CGID Cc1nc2n(n1)C[C@H](N[C@H]1CC[C@H](C)c3ccccc31)CC2 160493860 RYFXMQOYVGYOPF-QEORTHHSSA-N 296.418 3.130 70 20 CGID CC(C)CCNC(=O)NCc1csc(-c2ccco2)n1 160646815 HBFDTWJLUOGDIG-UHFFFAOYSA-N 293.392 3.248 70 20 CGID CC(C)CN(C(=O)c1ccc(C(C)C)nc1)C1CC1 160908350 JQFYAAGNSVVKNH-UHFFFAOYSA-N 260.381 3.466 70 20 CGID CC[C@@H](NC[C@H]1CCc2ccccc21)c1cnn(C)c1 160960819 KMHLZFFNXUXKSW-RHSMWYFYSA-N 269.392 3.191 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H]2CCCc3c2cnn3C)C1 159452167 NXOHMMIVWODTET-VNHYZAJKSA-N 293.480 3.451 70 20 CGID Cc1cc(C)cc(CCN[C@@H]2C[C@@H](C)N(C)C[C@@H]2C)c1 159475455 LJZGFVNQYYRWDB-LZLYRXPVSA-N 274.452 3.164 70 20 CGID O=C(C1=CCCC1)N(Cc1cccs1)C[C@H]1CCCO1 159795386 KEYUYAMVACEFAU-CQSZACIVSA-N 291.416 3.366 70 20 CGID CC(C)(C)SCC(=O)N[C@@H]1CCCc2cc(N)ccc21 159365375 UDFWDGJAAQFPJX-CQSZACIVSA-N 292.448 3.294 70 20 CGID Cc1ccccc1[C@H](C)NCCCc1cnn(C)c1 159423170 FKSQFPXMXDZJFE-AWEZNQCLSA-N 257.381 3.012 70 20 CGID Cc1ccc(CNc2cccc(-n3ccnc3)c2)cn1 159569714 PYDZUUJBHPYUPR-UHFFFAOYSA-N 264.332 3.188 70 20 CGID CCCn1nccc1CNc1cccc2ncccc12 159958930 SQUXJKSNEZTLCI-UHFFFAOYSA-N 266.348 3.453 70 20 CGID CCCn1nccc1CN[C@@H](C)Cc1ccccc1C 160099038 HXTQDMUREBMTOO-HNNXBMFYSA-N 271.408 3.322 70 20 CGID O=C(NCCCc1ccccc1)NCc1cccc(F)c1 217314820 CZEMITXBEOODHB-UHFFFAOYSA-N 286.350 3.258 70 20 CGID C[C@]1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CC=CCC1 864237880 BGNRGFINVRVLFR-AWEZNQCLSA-N 297.351 3.030 70 20 CGID O=C(Nc1c(F)cccc1F)N[C@H]1CCO[C@@H](C2CC2)C1 161000040 ZEOHALRRNQWXSC-GXFFZTMASA-N 296.317 3.044 70 20 CGID CCOCCC1(C(=O)N(C)c2ccccc2)CCC1 161171436 GRCGOHASHMULIA-UHFFFAOYSA-N 261.365 3.246 70 20 CGID Cc1nccn1CCCN1CCC(c2ccc(O)cc2)CC1 161367196 IGIGPXAJPGOPOG-UHFFFAOYSA-N 299.418 3.167 70 20 CGID CCCCn1ncc(NC(=O)NCC2(CC)CC2)c1C 160022041 VMBWEZDHISCIFE-UHFFFAOYSA-N 278.400 3.303 70 20 CGID CC(C)(CC(=O)NCCc1cccc(O)c1)c1ccccc1 160248728 KNMAGFZHOUBXIH-UHFFFAOYSA-N 297.398 3.419 70 20 CGID C[C@@H](CC(=O)N(C)C(C1CC1)C1CC1)c1ccncc1 160284917 QILOBJXSRCAAFQ-LBPRGKRZSA-N 272.392 3.222 70 20 CGID Cc1cccc2nc(CN[C@@H](C)c3cncc(F)c3)cn12 160327476 ONZLLGJJXZYCEE-LBPRGKRZSA-N 284.338 3.028 70 20 CGID CC1(C)CCC(CNC(=O)NCc2nccs2)CC1 160433192 YQBNLAMALOIYEG-UHFFFAOYSA-N 281.425 3.159 70 20 CGID Cc1nnc(N[C@H]2CCO[C@H](c3ccccc3)C2)s1 160534400 DSVUCCCNHMYZDG-STQMWFEESA-N 275.377 3.179 70 20 CGID CCC[C@H](C(=O)NCCc1cccs1)C(C)C 160543807 LXFWTKMRRBPKIQ-ZDUSSCGKSA-N 253.411 3.479 70 20 CGID Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(CC(F)F)C(C)C 159688614 LGMNNPUPAFOZOJ-SECBINFHSA-N 287.354 3.022 70 20 CGID CCc1noc(C)c1CNc1ccc(F)c(NC(C)=O)c1 159367127 CUVKIWKMVINGSV-UHFFFAOYSA-N 291.326 3.255 70 20 CGID CCOc1ccc([C@@H](C)NCC2(CO)CCCC2)cc1 160096811 BRBQDXIMXXLKPL-CQSZACIVSA-N 277.408 3.289 70 20 CGID COc1cc(NC(=O)c2ccc(O)c(Cl)c2)ccc1F 160406479 MSRHMVISDNYODI-UHFFFAOYSA-N 295.697 3.446 70 20 CGID C[C@@H]1CCC[C@H](C(=O)Nc2ccc3c[nH]nc3c2)C1 159766483 IFTITLFRGPYCLQ-MNOVXSKESA-N 257.337 3.328 70 20 CGID CN(CC1=CCCOC1)Cc1ccccc1Cl 160822921 CTWUXJJCJGOKOZ-UHFFFAOYSA-N 251.757 3.119 70 20 CGID Cc1cccc(C(=O)NC2CC(C)(C)NC(C)(C)C2)c1F 161034656 MMTYBBUEGVBBBA-UHFFFAOYSA-N 292.398 3.173 70 20 CGID CCN1CCCC[C@H]1CN[C@@H](C)c1cccnc1Cl 161173438 UXOXPQQGPWYJJZ-STQMWFEESA-N 281.831 3.260 70 20 CGID C[C@@H](C(=O)N[C@H]1CCc2c(O)cccc21)c1ccsc1 160236249 IOHKEAHNFZMWKJ-YGRLFVJLSA-N 287.384 3.361 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N[C@@H]1CCCc2ccccc21 160371365 NJLGQMGMEFDUKT-XGWLTEMNSA-N 285.387 3.186 70 20 CGID Cc1cccc(C)c1CN[C@H](C)c1nnc2ccccn12 160415963 RFDOVUAGMIMATK-CQSZACIVSA-N 280.375 3.197 70 20 CGID CCCC1(CNC(=O)c2c(F)ccc(F)c2OC)CC1 160794202 XDGNGIMEXPKQKD-UHFFFAOYSA-N 283.318 3.284 70 20 CGID Cc1cc2cc(NC(=O)[C@H]3CCC(=O)C[C@H]3C)ccc2[nH]1 159852160 OYAKVFKAPNIEBS-BMIGLBTASA-N 284.359 3.420 70 20 CGID CCc1cccc(CC)c1NC(=O)N[C@]1(C)CCOC1 159464584 WVAQLXQLZQIKMZ-MRXNPFEDSA-N 276.380 3.112 70 20 CGID C[C@](O)(CN[C@H]1CCc2cc(F)ccc21)c1ccsc1 159872090 HVZAXYVJBWLNFH-HOTGVXAUSA-N 291.391 3.372 70 20 CGID CCS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)CC2CC2)cc1 159503479 VCYQTRXNBNGRJE-CHWSQXEVSA-N 295.448 3.319 70 20 CGID Cc1noc(C)c1C[C@@H](C)Nc1nc(C(C)(C)C)ns1 159569183 PQLJMXZCRKZEFL-MRVPVSSYSA-N 294.424 3.484 70 20 CGID C[C@@H](CNCc1ccc(C2CC2)cc1)N(C)C1CC1 217555976 CYGIKOPXIDKUIM-ZDUSSCGKSA-N 258.409 3.136 70 20 CGID CCc1ncnc(NCCSc2ccccc2)c1F 217960674 ADJWOUMCCWNMGQ-UHFFFAOYSA-N 277.368 3.382 70 20 CGID Cc1ccc(C2CC(NCC3(CO)CCCC3)C2)cc1 160106286 GVSBSSHPLCJOBR-UHFFFAOYSA-N 273.420 3.383 70 20 CGID CC[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc(OC)cc1 217659843 CULWOIYAUWPDEH-BZSNNMDCSA-N 288.435 3.363 70 20 CGID COc1ccc(C(F)(F)c2nc(CC(C)C)no2)cc1 161506712 DUERWMXCJMCQCE-UHFFFAOYSA-N 282.290 3.417 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@@](C)(CCC)C1 160105206 DIHZPBAWKKFLEX-MRXNPFEDSA-N 278.444 3.399 70 20 CGID Cc1cccc2c1CCN2C(=O)C[C@H](C)c1ccncc1 160271971 LFIQDALOAJYDHD-AWEZNQCLSA-N 280.371 3.473 70 20 CGID CC[C@H](C)OCC(=O)Nc1nc(C(C)(C)C)cs1 160510980 NYQUFHABWRWOIF-VIFPVBQESA-N 270.398 3.194 70 20 CGID CCc1ccsc1C(=O)N(C)c1ccc2c(c1)OCO2 160516275 MHLWSJSQSPAHST-UHFFFAOYSA-N 289.356 3.316 70 20 CGID CCn1ccnc1CN(Cc1ccccc1OC)C1CC1 160816118 RVAHYKCABWJILF-UHFFFAOYSA-N 285.391 3.076 70 20 CGID C[C@H](CC(=O)N1c2ccccc2OC[C@H]1C)c1ccncc1 160906355 PQZUWYSJIFRWFS-ZIAGYGMSSA-N 296.370 3.389 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CC(F)(F)F 160935239 OVNOVYXRQZFLSM-NXEZZACHSA-N 251.292 3.366 70 20 CGID CC[C@H](CSC)NC(=O)Nc1ccnc(C)c1Cl 159679275 MRRZJQORXOTJIC-SECBINFHSA-N 287.816 3.307 70 20 CGID C[C@@H]1C[C@@H]1c1ccc(CN(CCn2ccnc2)C2CC2)o1 159695237 VKZMAZBHIJVYDV-CJNGLKHVSA-N 285.391 3.264 70 20 CGID C[C@@H]1CCC[C@H](C(=O)N(Cc2cccnc2)C2CC2)C1 159771809 QQMGSYGGXNEILU-HIFRSBDPSA-N 272.392 3.399 70 20 CGID CC1CCN(C(=O)NC[C@H]2CCC[C@H](C)C2)CC1 218051414 RFLYPWOIMBQUMY-KBPBESRZSA-N 252.402 3.254 70 20 CGID Fc1cc(Cl)cc(CN[C@H]2CCN3CCCC[C@H]23)c1 160854724 ARXZNLDXHZWMDA-LSDHHAIUSA-N 282.790 3.196 70 20 CGID CSCC[C@H](C)N(C)C(=O)C[C@H]1CNc2ccccc21 161250583 QMXADYUSXUBEDA-STQMWFEESA-N 292.448 3.186 70 20 CGID CCCCNC(=O)CN(c1ccccc1C)C(C)C 216925291 AOQOGECFTBJODZ-UHFFFAOYSA-N 262.397 3.126 70 20 CGID Cc1ccccc1N(CC(=O)N1CCC(C)CC1)C(C)C 216923984 YXEXWUWDFWUPSG-UHFFFAOYSA-N 288.435 3.468 70 20 CGID O=S(=O)(Cl)C[C@@H](F)c1c(F)cccc1Cl 1537958989 RUFKBISPNIVATG-SSDOTTSWSA-N 275.103 3.058 70 20 CGID CC[C@H](SCC(=O)NC1CC1)c1ccc(F)cc1F 161366361 QYCVSIZKHHYLRT-ZDUSSCGKSA-N 285.359 3.428 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)Cc1cccc(Br)c1 161473949 TTWXSCVLJBHKRQ-PHIMTYICSA-N 296.208 3.391 70 20 CGID C[C@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C[C@H]1C 160011074 GRXPZBUUZLYWKT-VHSXEESVSA-N 267.760 3.245 70 20 CGID CCc1nn(C)c(Cl)c1C(=O)N1CC[C@@H](C)C[C@@H](C)C1 160047508 OCKLLQRQNKEMTE-GHMZBOCLSA-N 297.830 3.144 70 20 CGID CCCCS[C@@H](C)C(=O)N(C)c1ccc2c(c1)OCO2 160103482 MGCZYQOCHGMTKG-NSHDSACASA-N 295.404 3.300 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 160518452 JZMWDUPDEIWPHT-WMLDXEAASA-N 286.375 3.410 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160652900 OJSVDNYQNLHQIW-IJEWVQPXSA-N 279.424 3.421 70 20 CGID COc1ccc(N(C)C(=O)[C@H](C)OCC2CC2)cc1Cl 159901603 CXYMVRPVGCFICX-JTQLQIEISA-N 297.782 3.127 70 20 CGID CC(C)[C@@H](O)CNC(=O)CCc1ccc(C(C)(C)C)cc1 159734651 SJUUSOFBMCELIL-INIZCTEOSA-N 291.435 3.050 70 20 CGID COc1ccc(NC(=O)N[C@H](C)C2CCC2)cc1OC 159389666 VMYSJIBZMZKBKO-SNVBAGLBSA-N 278.352 3.014 70 20 CGID C[C@@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)[C@H](C)C1 159791945 XYIGSJCPCPJAIX-HUUCEWRRSA-N 294.483 3.392 70 20 CGID CCc1ncsc1C(=O)N[C@@H](CC)c1c(C)noc1C 159993350 RMEBHKBZXVZGGR-JTQLQIEISA-N 293.392 3.191 70 20 CGID CCCn1nccc1CNc1cccc2cccnc12 159955969 BMKRRUYQZXYGRC-UHFFFAOYSA-N 266.348 3.453 70 20 CGID CC[C@@H](C)[C@H](NCc1ccc(Cl)cc1F)C(=O)OC 160743060 XRGFSGGSZJGCEB-RNCFNFMXSA-N 287.762 3.156 70 20 CGID CCOC(=O)CN[C@@H](c1ccc(F)cc1)C(C)(C)C 159553339 OCMTVYSWTDKDJR-AWEZNQCLSA-N 267.344 3.066 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2ncc(C)o2)n1 160134853 IPNICZKGWMYLGC-AWEZNQCLSA-N 257.337 3.024 70 20 CGID CC1(C)C[C@@H](NC(=O)Nc2ccc3c(c2)CCC3)CCO1 161020634 IAFWCEVXUOMVSK-HNNXBMFYSA-N 288.391 3.254 70 20 CGID CCCC(O)(CCC)CC(=O)Nc1cc([C@@H]2C[C@@H]2C)n[nH]1 161034769 JAKSUUZZFMJRAU-NWDGAFQWSA-N 293.411 3.193 70 20 CGID CC[C@H](NCC1(c2ccc(F)cc2)CC1)[C@H]1CCOC1 161371493 CXMXSOYOHUOPMV-BBRMVZONSA-N 277.383 3.262 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)[C@H](CC)CC1CCCC1 160083808 REHRWWFQTGLNOC-TZMCWYRMSA-N 283.412 3.051 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@H]1CCCOC1 160187542 DHVJCWIWFATLSQ-STQMWFEESA-N 278.348 3.034 70 20 CGID CC[C@H](NC(=O)CCC1CCC1)c1c(C)noc1C 160267184 JSPNGNRKQDMVDN-ZDUSSCGKSA-N 264.369 3.439 70 20 CGID COCCN(Cc1ccccc1)Cc1cccc2c1OCO2 160442672 YQWBRTQZCRGMFA-UHFFFAOYSA-N 299.370 3.064 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cccc(Cl)c1OC 160806916 QVFLBCTWYKMMIF-SECBINFHSA-N 271.744 3.102 70 20 CGID Cc1cc(N[C@H](C)CCn2cccn2)ccc1N(C)C 159416909 MOOCSPIEJLILGC-CQSZACIVSA-N 272.396 3.148 70 20 CGID CCOCCC1(CNC(=O)NCCCC(C)C)CCC1 159618293 MXMORSZMEGRRCQ-UHFFFAOYSA-N 284.444 3.319 70 20 CGID CC1(C(=O)NC2CC=CC2)CCN(Cc2ccccc2)CC1 159446306 OQHVWVNNFYGGFZ-UHFFFAOYSA-N 298.430 3.124 70 20 CGID C[C@@H](c1cccs1)N(C)C(=O)[C@H](O)c1ccccc1 159932804 YKCJRDRJWXFRGN-SMDDNHRTSA-N 275.373 3.001 70 20 CGID COCCOc1ccc([C@@H](C)N[C@@H]2CCCSC2)cc1 159555223 XZZDYNYAHSJPIO-UKRRQHHQSA-N 295.448 3.258 70 20 CGID CC[C@H](C)NC(=O)NCCc1cccc(Br)c1 217474136 YVLSDNLMBUTMHB-JTQLQIEISA-N 299.212 3.089 70 20 CGID CC[C@H](NCC1(CO)CCCC1)c1ccc(OC)cc1 160118651 XSFJULAVNISIEC-INIZCTEOSA-N 277.408 3.289 70 20 CGID CCC[C@@H]1CCCN(C(=O)c2csc(NCC)n2)C1 160374855 SGXWLOTXHONUDO-LLVKDONJSA-N 281.425 3.227 70 20 CGID CCOCCCN1CCO[C@H](c2ccccc2Cl)C1 160561276 SIABNSOERNFFIK-HNNXBMFYSA-N 283.799 3.140 70 20 CGID CCCCOCCN1CCC[C@@H]1c1cccc(C)n1 159735665 LVDZIMGZUHMAIG-MRXNPFEDSA-N 262.397 3.344 70 20 CGID Cc1ccsc1CCCc1nc(-c2cnccn2)no1 161029095 SHCYHNRBWRBYBC-UHFFFAOYSA-N 286.360 3.072 70 20 CGID C[C@H]1Sc2ccccc2N(CCn2cccn2)[C@@H]1C 161184747 GXMKCUGSRNSTQG-CHWSQXEVSA-N 273.405 3.272 70 20 CGID CC(C)[C@@H](CNC(=O)[C@@H]1CCCCO1)c1ccccc1 161429148 AOSXWAQHAPDRPX-CVEARBPZSA-N 275.392 3.112 70 20 CGID CCCC(O)(CCC)CC(=O)NC[C@@H]1Cc2ccccc21 160115145 FFIHOPZHFPFBEM-HNNXBMFYSA-N 289.419 3.164 70 20 CGID Cc1cc(C)cc(C(=O)N(C)c2ccc3c(c2)OCO3)c1 160427759 YTZSVGZCQCZDTQ-UHFFFAOYSA-N 283.327 3.309 70 20 CGID CC(C)CCO[C@@H](C)C(=O)Nc1cccc(OCCF)c1 160468550 GHYMLORNPUETHA-ZDUSSCGKSA-N 297.370 3.425 70 20 CGID CCN(C(=O)N[C@@H]1CCN(C2CCCC2)C1)[C@H](C)C(C)C 160901627 DBUKXXIQKBQLMS-HUUCEWRRSA-N 295.471 3.079 70 20 CGID CCOc1cccc(CN[C@@H](C)c2cnc(C)nc2C)c1 159388738 WKOUFPHJSPUCGF-LBPRGKRZSA-N 285.391 3.343 70 20 CGID CSC[C@@](C)(O)CNCc1cccc2ccccc12 217867036 INFDIORLHNDVPM-INIZCTEOSA-N 275.417 3.043 70 20 CGID Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159476728 RKYRNDDVDVYYLP-OAGGEKHMSA-N 257.377 3.042 70 20 CGID CCCn1nccc1CN[C@H](C)Cc1ccccc1C 160099167 HXTQDMUREBMTOO-OAHLLOKOSA-N 271.408 3.322 70 20 CGID CCOc1ccc(CNC(=O)Nc2nc(C)cs2)cc1 217300842 CKWBQBLBSYPKTL-UHFFFAOYSA-N 291.376 3.172 70 20 CGID CC[C@@H](c1ccc(F)cc1)N1CCC[C@@H](CNC(C)=O)C1 217237932 GKTANAVMOBXBAI-YOEHRIQHSA-N 292.398 3.125 70 20 CGID CCC[C@@H](C(=O)NC[C@@H](c1ccco1)N(C)C)C(C)C 161053524 SSPNIMNGDIQESP-KGLIPLIRSA-N 280.412 3.071 70 20 CGID O=C(CCC1CCCCC1)NOCc1nccs1 161327563 ZGJXENWHSVDFFS-UHFFFAOYSA-N 268.382 3.051 70 20 CGID CCN1CC[C@@H](NCC2(c3ccc(F)cc3)CC2)[C@H](C)C1 161355606 HPEVQKMFMMOKSM-RHSMWYFYSA-N 290.426 3.177 70 20 CGID COC(=O)CCCC(=O)N(Cc1ccccc1)C(C)(C)C 160055881 NHSIWAIOBNGJCR-UHFFFAOYSA-N 291.391 3.157 70 20 CGID C[C@H](CCC(=O)NCC1(O)CCCCC1)c1ccccc1 160571978 AUPWNFIOJDJBNS-OAHLLOKOSA-N 289.419 3.382 70 20 CGID CCOCCC1(C(=O)NCCc2ccccc2F)CCC1 160661096 CICMXEOCVJUVPI-UHFFFAOYSA-N 293.382 3.081 70 20 CGID CN(Cc1cccn1C)C(=O)/C=C/SCc1ccco1 160666498 OGRZXPJVFSZUPU-JXMROGBWSA-N 290.388 3.024 70 20 CGID Cc1nc(CC(C)C)c(C(=O)Nc2cccc(F)n2)s1 160790760 PQEBICTUEXUPEA-UHFFFAOYSA-N 293.367 3.436 70 20 CGID C[C@@H](c1nc(C2CCOCC2)no1)c1c(F)cccc1F 160869024 QPIJMWBBBNRWNR-SECBINFHSA-N 294.301 3.394 70 20 CGID C[C@H](Nc1ccc2[nH]ccc2c1)C(=O)OC(C)(C)C 160915530 PTIDBBGUTLHNJW-JTQLQIEISA-N 260.337 3.310 70 20 CGID CN(C)c1ccc(Cl)cc1NC(=O)NC1CC=CC1 160916341 SZGZMQHHJHQMDL-UHFFFAOYSA-N 279.771 3.246 70 20 CGID COc1c(Cl)cccc1NC(=O)C[C@H](C)SC 160952223 REUZMKPRUHOOEG-QMMMGPOBSA-N 273.785 3.429 70 20 CGID CCS(=O)(=O)NCc1ccc(-c2cccc(C)c2)cc1 159478463 MXFFCEAGGZCEMS-UHFFFAOYSA-N 289.400 3.101 70 20 CGID CCCCc1cc(NC(=O)c2ccc(F)c(OC)c2)[nH]n1 159671868 YSCBCWYVYJBUQR-UHFFFAOYSA-N 291.326 3.152 70 20 CGID O=C(N[C@H](c1ccccc1)C1CC1)c1ccccc1O 217565799 KLGIXTXVBKORCT-MRXNPFEDSA-N 267.328 3.273 70 20 CGID COc1cccc(CN[C@@H](C)c2cccc(C)c2)n1 160243481 KPKDTVSRUUUELZ-ZDUSSCGKSA-N 256.349 3.249 70 20 CGID Cc1cc(F)ccc1OCC(=O)c1cc(C)n(C)c1C 160592442 XYIVLZCAPQJAHZ-UHFFFAOYSA-N 275.323 3.351 70 20 CGID CS(=O)(=O)c1ccc(CSCCC(F)(F)F)cc1 217057990 WBRPBTHSWKRMTB-UHFFFAOYSA-N 298.351 3.276 70 20 CGID CCN(Cc1ccccn1)[C@H](C)C(=O)Nc1cccc(C)c1 161121003 JKRDSVAWJNUEBS-OAHLLOKOSA-N 297.402 3.239 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1c(C)noc1C 161243996 JZYBEMURUIQGEO-STQMWFEESA-N 264.369 3.332 70 20 CGID CCOc1cc(C)ccc1NC(=O)N(C)[C@@H]1CCSC1 161371424 IPPNCTNHEGVCMU-GFCCVEGCSA-N 294.420 3.363 70 20 CGID COc1ccc2ccc(OC(=O)[C@@H]3CCCCO3)cc2c1 160148244 YTSQYPFWAMCCRF-INIZCTEOSA-N 286.327 3.323 70 20 CGID CC(C)C[C@@H](C)NC(=O)NC[C@@]1(C)CCCS1 160277513 IEEMDGCYPIVBMG-DGCLKSJQSA-N 258.431 3.006 70 20 CGID CC(C)(C)SCCCC(=O)Nc1cccc(F)n1 160891089 WUIBWWIWVKBOFU-UHFFFAOYSA-N 270.373 3.471 70 20 CGID Cc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H](C)CCO 159822240 GJCDAHIKCXMROA-HOCLYGCPSA-N 292.423 3.152 70 20 CGID O=C(CCCn1cccc1)NCCc1cc2ccccc2o1 159637586 DFIHQFKNIIXHNV-UHFFFAOYSA-N 296.370 3.373 70 20 CGID CCC[C@@H](C)NC(=O)[C@H](C)Nc1ccn(CCC(C)C)n1 159921580 RZBOILXSKLPYCQ-KGLIPLIRSA-N 294.443 3.034 70 20 CGID C[C@H](NC(=O)[C@H]1CCCCO1)c1ccccc1Cl 159930317 VMGKCGKNANCYPK-GXFFZTMASA-N 267.756 3.086 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)N[C@@H](C)c1cccnc1 159748563 IUNXMDXOAFPCRI-FPMFFAJLSA-N 286.400 3.432 70 20 CGID COc1cc(NC(=O)N[C@@H](C)C2CCC2)cc(OC)c1 159395516 KGQGGDXQWRNWRN-JTQLQIEISA-N 278.352 3.014 70 20 CGID C[C@H](CCc1ccccc1)SCCN1CCOCC1 159996044 JQDMDYGHAXMYAI-OAHLLOKOSA-N 279.449 3.073 70 20 CGID Cc1cc(NC(=O)NC2CCC2)c2ccccc2n1 160324237 OTAMQTHUWVTEHE-UHFFFAOYSA-N 255.321 3.217 70 20 CGID COc1ccc2c(c1)CCC[C@@H]2NC[C@@H]1CCCN(C)C1 217571398 DSHKQURYYKKANV-KSSFIOAISA-N 288.435 3.004 70 20 CGID C[C@@H]1C[C@@H](N[C@@H]2CCCSC2)CN1Cc1ccccc1 159548936 JIOMBDOBIXAZEI-DJIMGWMZSA-N 290.476 3.135 70 20 CGID CC(C)[C@@H]1CCc2ccccc2N1C(=O)[C@@H]1CCCO1 161208403 UKPQKUJSYIFBGJ-HOCLYGCPSA-N 273.376 3.169 70 20 CGID CCC(CC)(CN)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 161222975 SMQPDHJQFQVRCY-CVEARBPZSA-N 288.435 3.204 70 20 CGID Cc1cccc(OCCCC(=O)NCC2(C3CC3)CC2)c1 160127002 ZQIAINDMSUXQEQ-UHFFFAOYSA-N 287.403 3.460 70 20 CGID CC(=O)c1c(F)cccc1N[C@H]1CCO[C@H](C2CC2)C1 160412982 BWZAGASVOJMCNS-WFASDCNBSA-N 277.339 3.398 70 20 CGID CCc1ccc([C@@H](CC)N[C@H]2CCc3nc(C)nn3C2)cc1 160426605 NEKDMNKCAZWQDU-DLBZAZTESA-N 298.434 3.205 70 20 CGID CC1(C)C[C@@H](NCc2ccc(F)c3cccnc23)CCO1 160532004 VKZJZKFNDJQTDV-ZDUSSCGKSA-N 288.366 3.421 70 20 CGID Cc1nc(NC(=O)C[C@H]2CC[C@H](C)C2)cc(C2CC2)n1 159955893 NCWVGCKTKNWXAR-JQWIXIFHSA-N 273.380 3.427 70 20 CGID C[C@@H](Cc1cccs1)NC(=O)CCCn1cccc1 159381779 LPXQWITZSGIWMC-ZDUSSCGKSA-N 276.405 3.077 70 20 CGID CSCCc1ccc(NC(=O)NC2CC=CC2)cc1 159779988 ZMDMQRXTGRYNNA-UHFFFAOYSA-N 276.405 3.432 70 20 CGID CC[C@H](C)[C@@H](NCc1coc2ccccc12)C(=O)OC 161083888 AGRIRCMZMBGWMY-XHDPSFHLSA-N 275.348 3.110 70 20 CGID CC[C@@H](C)NCCCc1nc2c(s1)CCCC2 160619978 RHWNFZZGARWNRJ-LLVKDONJSA-N 252.427 3.343 70 20 CGID Cc1nccn1CCCCN(C)[C@@H](C)c1ccco1 161502105 NEJWZGIWLJCJCI-ZDUSSCGKSA-N 261.369 3.258 70 20 CGID CCc1noc(C)c1C[S@](=O)c1ccc(C)cc1 161034839 UYDUCZIOVFRIML-GOSISDBHSA-N 263.362 3.162 70 20 CGID NC1(CC(=O)N(CC2CCC2)c2ccccc2)CCC1 161439063 KYFJBVDWWRINGD-UHFFFAOYSA-N 272.392 3.091 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@@H](C)C2CCOCC2)c1 160011752 OQMSDBNEAOQKSZ-STQMWFEESA-N 293.407 3.170 70 20 CGID CC(C)CCOc1ccc(NC(=O)C[C@@H]2CCCN2)cc1 160307834 NRKGPHSAYZIGNO-HNNXBMFYSA-N 290.407 3.192 70 20 CGID Cc1c(CNCc2nc(-c3ccccc3)cs2)cnn1C 160406701 JQVISMZDVSCDIS-UHFFFAOYSA-N 298.415 3.142 70 20 CGID Cc1nnc(-c2cccc(C(=O)N(C(C)C)C(C)C)c2)o1 160431289 JCJAXMPKFYGZAG-UHFFFAOYSA-N 287.363 3.304 70 20 CGID Cc1ncccc1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160445136 RINGEMKWXHZHTM-CQSZACIVSA-N 288.391 3.002 70 20 CGID CCc1nc2c(s1)[C@H](NC[C@H]1CCCC[C@@H]1O)CCC2 160551538 FJQFYMXFLKGGTG-BZPMIXESSA-N 294.464 3.224 70 20 CGID CC[C@@H](C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160751655 RWAKLNCXNVQUSX-CHWSQXEVSA-N 253.386 3.031 70 20 CGID Cc1ccc([C@H](C)N(C)CCCS(=O)(=O)C(C)C)cc1 160870963 BQIITGYLEMCLOJ-HNNXBMFYSA-N 297.464 3.201 70 20 CGID CC[C@H](OC1CCCCC1)C(=O)Nc1ccncc1 159607513 SWPKVPIGKWNPRM-AWEZNQCLSA-N 262.353 3.148 70 20 CGID CC(C)n1nccc1C(=O)N[C@@H]1CCCc2sccc21 159852106 KPTUFYDPUBDGPA-GFCCVEGCSA-N 289.404 3.333 70 20 CGID COC[C@@H](NCc1c(C)nn(-c2ccccc2)c1C)C1CC1 159874836 COVYIUIAHDMJPH-GOSISDBHSA-N 299.418 3.004 70 20 CGID CCCCn1ncc(C(=O)NC2CCCCCC2)c1C 159555151 SQXGEOGVBBRIOI-UHFFFAOYSA-N 277.412 3.444 70 20 CGID Cc1cc(C(=O)N(C)Cc2ccco2)cc(C)c1F 160833708 QHQBXOQSXGFHPW-UHFFFAOYSA-N 261.296 3.308 70 20 CGID Cc1ccoc1C(=O)NCCCN[C@@H](C)c1ccccc1 161215117 CKLZIGACMRRGIQ-AWEZNQCLSA-N 286.375 3.059 70 20 CGID CCNC(=O)CN(CC)C1c2ccccc2-c2ccccc21 160121932 KGEAXIMEFRTOLD-UHFFFAOYSA-N 294.398 3.214 70 20 CGID CC1(C)C[C@@H](NC(=O)Nc2cccnn2)c2ccccc21 160523651 XXROSJFGUGIFAR-CYBMUJFWSA-N 282.347 3.021 70 20 CGID CC(C)n1ccnc1CN(C)CCOc1ccccc1F 160721359 ICXQAMQQYLUSHW-UHFFFAOYSA-N 291.370 3.114 70 20 CGID CCN(Cc1ccc(Cl)c(Cl)c1)Cc1nncn1C 160824893 CTGUFAQNRONVFK-UHFFFAOYSA-N 299.205 3.144 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CCOC(C)C 160814968 UTCBKFBCDHILBO-KBPBESRZSA-N 255.402 3.229 70 20 CGID CN(CC1CCC1)CC1CCN(C(=O)C(C)(C)C)CC1 159623047 VDCLDHYPRQQMBS-UHFFFAOYSA-N 280.456 3.003 70 20 CGID COc1ccc(NC(=O)N[C@@H](C)C2CCC2)c(OC)c1 159447250 NMXOJPSRPITXCK-JTQLQIEISA-N 278.352 3.014 70 20 CGID CC(C)CCn1ccc(N[C@H](C)c2nc(C3CC3)no2)n1 159888868 IXDVIEOUOPOBOL-LLVKDONJSA-N 289.383 3.363 70 20 CGID CC[C@H]1CN(c2nc(C(C)(C)C)ns2)CCS1 159760084 QUPUTINGCNBIRC-VIFPVBQESA-N 271.455 3.167 70 20 CGID C[C@@H]1C[C@@H]1c1ccc(CNCCNC(=O)OC(C)(C)C)o1 218117985 GNIUMPNSCRORRY-YPMHNXCESA-N 294.395 3.017 70 20 CGID CC[C@H](C)[C@H](C)NC(=O)NCCc1ccc(C)cc1 217224330 NCVLYTCVPISPHG-KBPBESRZSA-N 262.397 3.271 70 20 CGID CCCN(CCC)C(=O)c1ccnc(Cl)c1F 160742306 IMRLPVNAONTIBB-UHFFFAOYSA-N 258.724 3.136 70 20 CGID Cc1ccc(/C=C/C(=O)N[C@H]2CCOC3(CCCC3)C2)o1 161359781 RSURZEVYKQVKDM-UZYOAWRESA-N 289.375 3.209 70 20 CGID CCC[C@@H]1CCCN(C(=O)C[C@@H](C)C2CCNCC2)C1 161447425 REJBWALWJCFWFB-HUUCEWRRSA-N 280.456 3.051 70 20 CGID CCOCCCN1CC[C@@H](N[C@@H](C)c2ccco2)[C@H](C)C1 160172693 WVXVXZNAYDPYFB-OWCLPIDISA-N 294.439 3.067 70 20 CGID CCC(N)(CC)CNC(=O)c1occc1-c1ccccc1 160551333 SNBJARYRJUKPOV-UHFFFAOYSA-N 286.375 3.194 70 20 CGID C[C@@H](NCC(C)(C)O)c1ccc(SCC(F)F)cc1 160590464 IRTFTLKPVLBFQS-SNVBAGLBSA-N 289.391 3.465 70 20 CGID Cc1cnccc1CCNC(=O)NC1(C)CCC(C)CC1 160810799 PMKWGSVMFYQMGN-UHFFFAOYSA-N 289.423 3.201 70 20 CGID C[C@H]1C[C@@H](NC[C@@H]2CCc3ccccc32)[C@H](C)CN1C 160972766 DGQHNIJNJANJDM-YQYZPQCESA-N 272.436 3.035 70 20 CGID CCC(C)(CC)C(=O)Nc1cc(C(=O)OC)cs1 159465381 IOQVLWCIKXLJNQ-UHFFFAOYSA-N 269.366 3.300 70 20 CGID CS[C@H](C)CNC(=O)c1ccc2ccccc2c1O 159437217 VTHKWWBMPRNRTO-SNVBAGLBSA-N 275.373 3.027 70 20 CGID O=C(OCCO)c1cc2cc(C(F)(F)F)ccc2s1 218635370 TUOVMJXAOYREIR-UHFFFAOYSA-N 290.262 3.069 70 20 CGID O[C@H](Cc1ccccc1)CN1CCC[C@@H]2CCCC[C@@H]21 218761089 MPLJGKQPUZBUGA-KSZLIROESA-N 273.420 3.245 70 20 CGID CC[C@@H](C(=O)NCC1(CCOC)CC1)c1ccc(F)cc1 161261754 NLTBGVRNECECNI-OAHLLOKOSA-N 293.382 3.252 70 20 CGID Cc1ccc(C(=O)CCN[C@@H](C)c2cccnc2)cc1 161415246 ARMYPTJEPOGATI-AWEZNQCLSA-N 268.360 3.314 70 20 CGID COc1ccc(N(C)C(=O)CC2CC2)cc1Cl 160217583 KOSRVTMNKSEOQT-UHFFFAOYSA-N 253.729 3.112 70 20 CGID O=C(CCC1CC1)N[C@@H]1CCOC2(CCCCC2)C1 160539338 BTUFOGRNNUGTTN-CQSZACIVSA-N 265.397 3.175 70 20 CGID CC[C@H](NCCCCc1nc(C)cs1)[C@H]1CCOC1 160695368 FEPDJTVHCHHRAS-KBPBESRZSA-N 282.453 3.179 70 20 CGID CCN(Cc1nncn1C)[C@@H](C)c1cc2ccccc2o1 160840034 CZXBYRYQJDNJNJ-LBPRGKRZSA-N 284.363 3.144 70 20 CGID CCc1ccc([C@@H](CO)Nc2cc(C)nc(C3CC3)n2)cc1 160914892 SRXKXVYZPLVARZ-MRXNPFEDSA-N 297.402 3.370 70 20 CGID Fc1ccc(-c2cnc(SCCn3ccnc3)[nH]2)cc1 159739456 JYVXNNDWXZEGGZ-UHFFFAOYSA-N 288.351 3.205 70 20 CGID COCC[C@H](Cc1cccc(F)c1)N[C@@H]1CCCSC1 159542716 MWWLRGRWPAGHQV-HZPDHXFCSA-N 297.439 3.259 70 20 CGID CCCC1(CNC(=O)N(C)CC2CCOCC2)CCC1 159956948 HIXZZDJGZISHQH-UHFFFAOYSA-N 282.428 3.025 70 20 CGID C=CC[Si@@]1(Cl)O[C@@H](c2ccccc2)[C@H](C)N1C 1857776902 XHCRAANIMMYPDV-PPHDSNJXSA-N 267.832 3.442 70 20 CGID Cc1cccc(C(=O)N[C@H](C)C(=O)OC(C)(C)C)c1Cl 160409100 NAQCWILZFDDJNP-SNVBAGLBSA-N 297.782 3.108 70 20 CGID CCSCCN(Cc1cccc(O)c1)CC1CC1 159912819 FYNFJYVAFWJDFO-UHFFFAOYSA-N 265.422 3.357 70 20 CGID Cc1nnc(CS[C@@H](C)c2c(F)cccc2F)n1C 161037193 ZVUKJJKAQBZOFB-QMMMGPOBSA-N 283.347 3.396 70 20 CGID CCCn1nc(C)c(C(=O)N(C)Cc2ccccc2)c1C 161121111 URGQFMZHRILGEQ-UHFFFAOYSA-N 285.391 3.182 70 20 CGID CC[C@@H](C)OCC(=O)N[C@H]1CCCc2sccc21 160125352 WHIPVJWPVCTWDZ-PWSUYJOCSA-N 267.394 3.057 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCCCN(C)Cc1ccccc1 160165960 NBCCMSJCMOHLHE-AEFFLSMTSA-N 288.435 3.061 70 20 CGID CCN1C(=O)c2cc(Cl)ccc2N[C@@H]1c1ccn(C)c1 160288757 IDRUROICCHMSKA-AWEZNQCLSA-N 289.766 3.265 70 20 CGID CC(C)n1ccnc1CN1C[C@H](c2ccccc2)O[C@H](C)C1 160850979 JPIHDFLJCVFRMT-NVXWUHKLSA-N 299.418 3.426 70 20 CGID CCN(CC)C(=O)NC1CCC(N2CCC(C)CC2)CC1 160947858 JONVSTTVMPNISE-UHFFFAOYSA-N 295.471 3.081 70 20 CGID COc1ccc(-c2noc([C@H]3CCC(=O)C[C@H]3C)n2)cc1 160996100 BCBCYKFSOVQDHL-YGRLFVJLSA-N 286.331 3.218 70 20 CGID Cc1cccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159477636 FIHCJSVEIACDBL-JYJNAYRXSA-N 257.377 3.042 70 20 CGID C[C@H]1CCN(C(=O)Nc2nnc(C(C)(C)C)s2)C[C@@H]1C 159763149 SBTRVNHOPVIIPM-UWVGGRQHSA-N 296.440 3.345 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc2ncccc2c1 159581594 SNQCRFYJHJCJJU-SNVBAGLBSA-N 260.362 3.315 70 20 CGID Cc1n[nH]c(C)c1[C@H](C)C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1 159790619 FVYWUFJRHDYYGD-BBGACYKPSA-N 277.412 3.071 70 20 CGID Fc1cccc(Cl)c1NCc1nnc2n1CCCC2 217319774 SEQHSEDPJIJCEQ-UHFFFAOYSA-N 280.734 3.019 70 20 CGID CC[C@@H](C)NCc1ccc(N2CCC(C)CC2)nc1 160497478 ZPJJCWBFQAOJLL-CQSZACIVSA-N 261.413 3.206 70 20 CGID OC[C@@H](Cc1ccccc1)NCc1cc(F)cc(Cl)c1 160936415 HYDAFSAYCZNFFA-MRXNPFEDSA-N 293.769 3.172 70 20 CGID CC[C@H](COCCC(C)(C)C)CS(=O)(=O)Cl 116968323 GDMQOEYTPBLTPV-SNVBAGLBSA-N 270.822 3.034 70 20 CGID O=C(Nc1ccccc1)Nc1ccn(CC(F)(F)F)n1 160810537 LYBPCCQTWKSQKY-UHFFFAOYSA-N 284.241 3.089 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1c1nc(-c2cnccn2)no1 161029916 UZYSVTOTZYZFEH-UWVGGRQHSA-N 284.344 3.168 70 20 CGID CC[C@@H](SCC(=O)NC1CC1)c1ccc(F)cc1 161342632 HNSGTLCOIMQSNU-CYBMUJFWSA-N 267.369 3.289 70 20 CGID CC(C)CCn1ccc(NC(=O)N(C)Cc2ccco2)n1 161409332 SARRDBUEHKUZTP-UHFFFAOYSA-N 290.367 3.186 70 20 CGID CN(C(=O)c1occc1-c1ccc(F)cc1)C1CC1 161483881 PDBDURMJSTVKGC-UHFFFAOYSA-N 259.280 3.320 70 20 CGID CCOCCC(=O)O[C@@H](C)c1cc(C)ccc1OC 160189129 RYHRGWXNRMPEQX-LBPRGKRZSA-N 266.337 3.034 70 20 CGID Cn1ccc(NC(=O)Nc2ccccc2OC(C)(C)C)n1 160400598 TURFMMJEJOZGLK-UHFFFAOYSA-N 288.351 3.241 70 20 CGID CCCCO[C@H](C)C(=O)Nc1cccc(OCCF)c1 160406174 XIDOXOKCMICCIN-GFCCVEGCSA-N 283.343 3.179 70 20 CGID CC1(C)C[C@H](NCC2=Cc3ccccc3OC2)CCO1 160516376 CYZUZFYQHDSCDC-OAHLLOKOSA-N 273.376 3.010 70 20 CGID Cc1cnc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)nc1 160574344 SSHTVSNLRTVQIH-HUUCEWRRSA-N 269.348 3.117 70 20 CGID C[C@H]1CCC[C@@H](OCCCCCC(=O)N(C)C)C1 160636991 TYAMZSQQPCINNP-UONOGXRCSA-N 255.402 3.230 70 20 CGID Cc1conc1NC(=O)[C@@H](C)Cc1ccc(Cl)cc1 160780399 UMXYLNFPUWCVDC-VIFPVBQESA-N 278.739 3.454 70 20 CGID CCC[C@@H](C(=O)NCc1cccc(OC)c1)C(C)C 160930799 PXPBFTKRXHZRMY-OAHLLOKOSA-N 263.381 3.384 70 20 CGID CCC(CC)n1nccc1C(=O)NC(C)(C)CC 160938901 PYZCWVHRYSWONG-UHFFFAOYSA-N 251.374 3.163 70 20 CGID CC[C@@H](NC(=O)Nc1cc(C)ccc1OC)[C@H]1CCCO1 159413069 CJZYTSZICAQIHQ-IUODEOHRSA-N 292.379 3.083 70 20 CGID Cc1cccc(OC[C@H](C)NC(=O)NC2(C)CCC2)c1 159892942 GXQJLRIKGGNYCS-ZDUSSCGKSA-N 276.380 3.004 70 20 CGID CN(Cc1ccc(Cl)c2cccnc12)[C@@H](CN)C1CC1 159765214 QMQRBXKWSLPQLV-HNNXBMFYSA-N 289.810 3.057 70 20 CGID COc1cccc(CNC(=O)NCCc2cccc(C)c2)c1 217314684 KCBCHXUOLPLSJX-UHFFFAOYSA-N 298.386 3.046 70 20 CGID Cc1cccc(C(=O)Nc2nc(-c3ccc[nH]3)cs2)c1O 217154523 VAWXZOPEGDLHBG-UHFFFAOYSA-N 299.355 3.405 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cc(OC)ccc1Cl 161353608 AQJDSFDNRYQAKD-SECBINFHSA-N 271.744 3.102 70 20 CGID CCCCN(C(=O)[C@@H]1CCCNC1)[C@H](C)c1ccccc1 161356187 OBMJBXNLNYGPIX-NVXWUHKLSA-N 288.435 3.376 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)[C@H](C)C(C)C)o1 161406168 BPXWKZNWVXFCBX-TZMCWYRMSA-N 279.380 3.382 70 20 CGID CCCNC(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F 161501426 FKKUTXPVZWLFQN-LLVKDONJSA-N 290.285 3.008 70 20 CGID CC[C@@H](CN[C@H](C)C1CCOCC1)Oc1ccccc1F 160341354 MKOUXRHNUAAZLC-HIFRSBDPSA-N 295.398 3.388 70 20 CGID CC(C)C[C@@H](C)OCCC(=O)Nc1cccc(F)n1 160588373 OZJPLWHOZBGGQK-LLVKDONJSA-N 268.332 3.001 70 20 CGID COc1ccc(CCNC(=O)c2ccc(C(C)C)nc2)cc1 159446808 QCDRNWWLWVXQBL-UHFFFAOYSA-N 298.386 3.186 70 20 CGID CC[C@H](C)[C@](C)(O)CNc1nc(C(C)(C)C)ns1 159448655 FWRHLKUFFAPXJN-TVQRCGJNSA-N 271.430 3.045 70 20 CGID c1ccc2oc(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2c1 159491100 CXRWXOHYHUXGQJ-UAGQMJEPSA-N 283.371 3.480 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@H]1Cc2ccccc2O1 159958160 DICUEQOGWOHDTB-DZGCQCFKSA-N 299.395 3.245 70 20 CGID CS[C@H](C)CC(=O)Oc1ccc(NC(=O)C2CC2)cc1 159988339 NLCXTMIWIRCQAZ-SNVBAGLBSA-N 293.388 3.082 70 20 CGID O[C@H](Cc1ccccc1)CN1CCC[C@@H]1Cc1ccccc1 218775145 GJUHIQSCYZDPEW-WOJBJXKFSA-N 295.426 3.297 70 20 CGID Cc1cccc(CCNC(=O)N[C@@H]2CCCC[C@@H]2C)c1 217406668 ORMTVBCLYSPKSQ-GOEBONIOSA-N 274.408 3.415 70 20 CGID CN(C)[C@@H]1CCC[C@@H](N[C@@H]2CCCOc3ccccc32)C1 161091897 LEKPSWFVYIVIEN-BFYDXBDKSA-N 288.435 3.363 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cccc2c1OCO2 161185189 GXHATAIXYWVWGU-GXTWGEPZSA-N 289.375 3.456 70 20 CGID CCCCOc1ccc(CCN[C@@H](C)[C@H]2CCOC2)cc1 161388228 QBFHLDJGZGCMIJ-RDJZCZTQSA-N 291.435 3.423 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2cccc(F)n2)CC1 161478268 WJTKSIIPODIKTP-UHFFFAOYSA-N 262.328 3.039 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)[C@H](CC)CC1CCCC1 160083604 REHRWWFQTGLNOC-GXTWGEPZSA-N 283.412 3.051 70 20 CGID CCCCCc1nnc(NC(=O)CO[C@@H](C)CC)s1 160352782 AONMVFMKLQYCCH-JTQLQIEISA-N 285.413 3.024 70 20 CGID CCOc1cccc(NCc2ccccc2NC(C)=O)n1 160585284 FRFJQJCEIQIAFQ-UHFFFAOYSA-N 285.347 3.051 70 20 CGID CCC(CC)CNC(=O)N1CC[C@@H](Nc2ccccc2)C1 160605531 XCOWIOWORAVKLK-MRXNPFEDSA-N 289.423 3.319 70 20 CGID CCOCCC1(C(=O)NC2CCCCCC2)CCC1 160607718 PVAGMYJMMSWMPA-UHFFFAOYSA-N 267.413 3.422 70 20 CGID COc1ccccc1[C@@H](C)CC(=O)Nc1cccc(F)n1 160776040 ACBDQMYGTQDHDM-NSHDSACASA-N 288.322 3.362 70 20 CGID CCOc1ccccc1NC(=O)N[C@@H](CC)[C@@H]1CCCO1 159455515 CIBKWADHGFLFTK-JSGCOSHPSA-N 292.379 3.164 70 20 CGID COc1cccc(CCCN(C)C[C@@H]2CCCCO2)c1 159536509 AVUPPYLGXRSSII-KRWDZBQOSA-N 277.408 3.129 70 20 CGID CSCC[C@H](C)N(C)c1nc(C(C)(C)C)ns1 159789018 XLJXJWFVUXIILY-VIFPVBQESA-N 273.471 3.413 70 20 CGID CCOC(CCN[C@H](C)c1ccc(F)cc1)OCC 159855852 RHQOHXWTGYQPIB-GFCCVEGCSA-N 269.360 3.266 70 20 CGID O=C(NCC1CCCCC1)Nc1cc(Cl)ccn1 217611247 XKVZVIJWUCVCNF-UHFFFAOYSA-N 267.760 3.437 70 20 CGID CC[C@H](C)NCCCc1nc2c(s1)CCCC2 160620103 RHWNFZZGARWNRJ-NSHDSACASA-N 252.427 3.343 70 20 CGID COC(=O)c1ccnc(N[C@H](C)c2ccc(C)s2)c1 217878833 MXNUBBITOBZUNF-SNVBAGLBSA-N 276.361 3.411 70 20 CGID CCOCCC1(C(=O)N2C[C@@H](C)C[C@@H](C)C2)CCC1 160517711 QNUYDLFWAUSFTK-OKILXGFUSA-N 267.413 3.088 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)C[C@@H]1CCCCO1 161139245 TVCDCIVUJOSTSL-ILXRZTDVSA-N 267.413 3.373 70 20 CGID CSC[C@H](CCO)N[C@H](C)c1cc2c(s1)CCCC2 160240596 WIHWFTPNBXUXLD-YPMHNXCESA-N 299.505 3.392 70 20 CGID CN(C[C@H]1CCCCO1)C(=O)C(C)(C)C1CCCC1 160784524 IGFHWMQCVVYQTO-CQSZACIVSA-N 267.413 3.230 70 20 CGID C[C@@H]1C[C@H](NCCOc2cccc3ccccc23)CCN1C 160811218 HWCOVEHGGDJEHN-NVXWUHKLSA-N 298.430 3.291 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CCOC(C)C 160815218 UTCBKFBCDHILBO-UONOGXRCSA-N 255.402 3.229 70 20 CGID C[C@@H](CCn1cccn1)Nc1cccc(OCCF)c1 159474692 XHJBIRNIKDWROX-ZDUSSCGKSA-N 277.343 3.122 70 20 CGID CC[C@@H](c1ccccc1)N(CC(=O)OC)Cc1ccccn1 159671254 BGXQIDBAWYXVSV-KRWDZBQOSA-N 298.386 3.208 70 20 CGID CCOc1ccccc1N(C)Cc1cccc(C(=O)NC)c1 159378530 WAHBGARAQPHPTC-UHFFFAOYSA-N 298.386 3.081 70 20 CGID CCOC(=O)CCC(=O)NC1CC(C)(C)CC(C)(C)C1 159724205 GKOFIRQAYHKYQT-UHFFFAOYSA-N 283.412 3.051 70 20 CGID CC1(C)C[C@H](NCc2cc(F)c(F)cc2F)CCO1 160561717 SKFBCUJMJGTOAE-SNVBAGLBSA-N 273.298 3.151 70 20 CGID CC(C)(C)C[C@H](CO)Nc1ccc(C(F)(F)F)cn1 161426871 CNNPTRCMEPKHMA-SNVBAGLBSA-N 276.302 3.309 70 20 CGID Cc1ccc(C(=O)OCc2cc3ccccc3o2)n1C 218571108 LLPVPWXVZVGZOP-UHFFFAOYSA-N 269.300 3.437 70 20 CGID CCN(CC)C(=O)CN(c1ccccc1C)C(C)C 216925253 DFMBMEAAMBBFPP-UHFFFAOYSA-N 262.397 3.078 70 20 CGID Cc1ccc(NC(=O)NCCc2ccc(O)cc2)cc1C 217310698 TUXGSMNGNUZXIW-UHFFFAOYSA-N 284.359 3.373 70 20 CGID CCC(C)(C)OCCCCCCS(=O)(=O)Cl 112155355 HPIHREBMWYIJSA-UHFFFAOYSA-N 270.822 3.321 70 20 CGID CCCCn1ncc(C(=O)N(CC)C2CCCC2)c1C 161210919 NTBLGBACGZDZAI-UHFFFAOYSA-N 277.412 3.396 70 20 CGID CCCCO[C@H](C)C(=O)N1CCc2c(Cl)cccc21 161458919 IBWXAOVPNRCKKM-LLVKDONJSA-N 281.783 3.434 70 20 CGID CSC[C@@H](C)C(=O)N[C@H]1CCCc2sccc21 160190925 ZYFRFZMXAIQQLU-KOLCDFICSA-N 269.435 3.241 70 20 CGID CC(C)=C[C@H]1[C@H](C(=O)NCCc2cccc(O)c2)C1(C)C 160217814 QYOAVNWRFSCMPO-JKSUJKDBSA-N 287.403 3.289 70 20 CGID CS[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 160278708 PELYTRQKTZWEIT-GFCCVEGCSA-N 278.421 3.367 70 20 CGID CCc1ccc(CCNC(=O)C[C@H](C)c2ccncc2)cc1 160700974 GVYNONZZTSLICO-HNNXBMFYSA-N 296.414 3.497 70 20 CGID CC(C)(C)SCCCC(=O)N1CC[C@@H]2OCCC[C@@H]2C1 160740217 RXPWPRFMEDPJAM-KGLIPLIRSA-N 299.480 3.326 70 20 CGID CC1(C)C[C@H]1C(=O)Nc1ccc(CCN2CCCC2)cc1 160860673 JRRBEYGKJREEEX-INIZCTEOSA-N 286.419 3.310 70 20 CGID COc1cc(C)ccc1N[C@H](C)CCn1cccn1 159423232 FXKUFDPSFHUXJG-CYBMUJFWSA-N 259.353 3.091 70 20 CGID Cc1ccccc1[C@@H](NC(=O)CCNC(C)C)C(C)C 159689541 DWYKDCKQSIYZLX-KRWDZBQOSA-N 276.424 3.196 70 20 CGID Cc1cc(C)cc(CCN[C@@H](C)C2CCN(C)CC2)c1 159514861 JUWOIIGOKRTLAY-INIZCTEOSA-N 274.452 3.166 70 20 CGID CS[C@@H]1CCC[C@H](NCc2ccccc2NC(C)=O)C1 160466225 KDLMHDFPPFWNNS-LSDHHAIUSA-N 292.448 3.409 70 20 CGID COc1cccc(CNC(=O)Nc2cc(Cl)ccn2)c1 217314689 QYMSSIKPMUXUJE-UHFFFAOYSA-N 291.738 3.065 70 20 CGID Cc1cc(Br)c(F)cc1NCC[C@H](C)O 160207313 OLKVNOPKOQFVNK-QMMMGPOBSA-N 276.149 3.079 70 20 CGID O=C(/C=C/c1cccs1)N[C@H]1CCOC2(CCCC2)C1 161315353 KTMWAKRSFRUQHA-GFUIURDCSA-N 291.416 3.369 70 20 CGID CC(C)(C)c1noc(-c2csc([C@H]3CCCO3)n2)n1 161440558 VLDQGQSJUMBYFW-SECBINFHSA-N 279.365 3.342 70 20 CGID C[C@@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C[C@@H]1C 160010633 GRXPZBUUZLYWKT-ZJUUUORDSA-N 267.760 3.245 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1oc(C)cc1C 160068175 JZRAUSAGSPSTLK-CQSZACIVSA-N 285.343 3.322 70 20 CGID CCCCNC(=O)N1C[C@H](c2ccsc2)O[C@H](C)C1 160185309 OGBWAGXSMUUDJY-DGCLKSJQSA-N 282.409 3.020 70 20 CGID CC(C)CONC(=O)Nc1cc(Cl)ccc1N(C)C 160406534 MRCWFVOJRZNAGT-UHFFFAOYSA-N 285.775 3.115 70 20 CGID Cc1cc(C)nc(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160577140 IWJIGZXMEHQNQP-CVEARBPZSA-N 283.375 3.426 70 20 CGID CCOCCC1(C(=O)NCCc2cccc(F)c2)CCC1 160748708 PZHMKEKLYCKCPC-UHFFFAOYSA-N 293.382 3.081 70 20 CGID C[C@H](CC(=O)N(C)Cc1cccn1C)c1ccccc1 160749593 LMVLUVDLYBPYSH-CQSZACIVSA-N 270.376 3.177 70 20 CGID CCC(CC)NC(=O)[C@@H](C)Nc1ccn(CCC(C)C)n1 159885680 RWZWLBZOYMUQIU-CYBMUJFWSA-N 294.443 3.034 70 20 CGID O=C(C[C@H]1C=CCC1)NCCc1cc2ccccc2[nH]1 159500897 LUQIUWDRMKJAFZ-ZDUSSCGKSA-N 268.360 3.183 70 20 CGID CCS[C@H]1CCC[C@@H]1NC(=O)c1ccc(F)c(OC)c1 159702832 YWRGQADRBUCOKF-JSGCOSHPSA-N 297.395 3.238 70 20 CGID C[C@H](NC[C@@](C)(O)c1ccsc1)c1cccnc1Cl 159957923 YXWJXRMXHHIWQS-IINYFYTJSA-N 296.823 3.355 70 20 CGID C[C@H](Cc1cccs1)NC(=O)CCCn1cccc1 159381915 LPXQWITZSGIWMC-CYBMUJFWSA-N 276.405 3.077 70 20 CGID Cc1cccc([C@@H](C)C(=O)NCc2nc(C)cs2)c1 159382055 LCWKREGTPZAQLM-GFCCVEGCSA-N 274.389 3.180 70 20 CGID COc1ccc(C)cc1[C@H](C)N[C@H]1CCN2CCCC[C@@H]12 217677821 LPIUWFRFLIXYKC-XIRDDKMYSA-N 288.435 3.281 70 20 CGID O=C(NCc1cccnc1)Nc1c(F)cccc1Cl 217313068 SBKJVXQLNHYBAW-UHFFFAOYSA-N 279.702 3.196 70 20 CGID Cc1cccc(OC[C@H](O)CNC[C@H]2CCCC[C@H]2C)c1 218442631 QRPXNXQEEHYSOP-BRWVUGGUSA-N 291.435 3.151 70 20 CGID CCNCC1CCN(C(=O)C[C@@H]2CCC[C@H](C)C2)CC1 161088469 UDJCHVAVHMXIDB-GOEBONIOSA-N 280.456 3.051 70 20 CGID CC(C)c1ccc(C(=O)NCCN(C(C)C)C(C)C)cn1 161097316 NXFQGVRRFJJHLT-UHFFFAOYSA-N 291.439 3.054 70 20 CGID CC[C@H](S[C@@H](C)C(N)=O)c1ccc(F)cc1F 161368705 BTUZDTSKULQFHR-CPCISQLKSA-N 259.321 3.023 70 20 CGID Cc1ccc(NC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)cn1 161369470 RRQGKBPLPKJAMI-GJZGRUSLSA-N 285.322 3.207 70 20 CGID C[C@H](Oc1ccc(Cl)cc1)C(=O)NCC1(C2CC2)CC1 160056460 GYIRHYWRHITNCX-NSHDSACASA-N 293.794 3.414 70 20 CGID Cc1ccc(C(=O)CCN2CCO[C@@H](c3ccco3)C2)cc1 160099278 VEYFMWKZCHZLSO-GOSISDBHSA-N 299.370 3.234 70 20 CGID FC(F)Oc1ccc(N[C@@H]2CCO[C@H](C3CC3)C2)nc1 160274834 PFTRUODOCFKIAN-PWSUYJOCSA-N 284.306 3.053 70 20 CGID CC(C)c1nsc(N[C@H]2CCO[C@H](C3CC3)C2)n1 160373417 SZAWLLVJPHMHGE-QWRGUYRKSA-N 267.398 3.031 70 20 CGID Cc1ccc(C)c(CC(=O)N(C)c2ccc3c(c2)OCO3)c1 160392370 SJQMEERKCDEMHL-UHFFFAOYSA-N 297.354 3.238 70 20 CGID CC(C)C[C@H](C)OCCC(=O)Nc1cccc(F)n1 160588508 OZJPLWHOZBGGQK-NSHDSACASA-N 268.332 3.001 70 20 CGID CCC[C@H](CC)NC(=O)Nc1ccn(CC(F)(F)F)n1 160790681 XXDBUTHODRISBZ-VIFPVBQESA-N 292.305 3.146 70 20 CGID CC(C)CCSCC(=O)N[C@H]1CCOC2(CCCC2)C1 159611869 PWVJMQGQYPLDSB-AWEZNQCLSA-N 299.480 3.374 70 20 CGID CCCN(Cc1ccccc1)C(=O)[C@H]1CCC(=O)C[C@H]1C 159618944 OKKSIFOISPTULL-PBHICJAKSA-N 287.403 3.431 70 20 CGID Cc1cccn2cc(CNC(=O)[C@H](C)c3cccs3)nc12 159474519 LNBKLGFDEQVJNO-GFCCVEGCSA-N 299.399 3.124 70 20 CGID C[C@H]1CCC[C@@H](C)N(C(=O)c2cccc3[nH]cnc23)C1 159677445 FCQKZVNPMBOCCS-NWDGAFQWSA-N 271.364 3.214 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)c1cccc(OC)c1 159681898 XBVXCKWRNDZLOK-WOSRLPQWSA-N 275.392 3.494 70 20 CGID CC(C)(CNC(=O)c1cccc2[nH]cnc12)c1cccs1 159549162 GYWBPBDZONIXNE-UHFFFAOYSA-N 299.399 3.332 70 20 CGID C[C@@H](O)C[C@H](CNC(=O)c1cccs1)c1ccccc1 159778166 LAJIDUAWXOSYCH-TZMCWYRMSA-N 289.400 3.033 70 20 CGID Cc1c(CN[C@H](C)c2ccc(F)c(Cl)c2)cnn1C 160870779 FAHXRGCKQWWKIL-SECBINFHSA-N 281.762 3.372 70 20 CGID CC(C)c1noc(OCC(=O)CCC2CCCC2)n1 160403731 MAJURYCBMXOTNU-UHFFFAOYSA-N 266.341 3.111 70 20 CGID Cc1ccc([C@@H](C)N[C@H]2CCC[C@H](N(C)C)C2)o1 161127155 BMKJRCPKYKPEMF-RDBSUJKOSA-N 250.386 3.111 70 20 CGID CCn1cc(NC(=O)N[C@@H]2CCCc3sccc32)cn1 161177919 WGYHAZVEPFVHKI-GFCCVEGCSA-N 290.392 3.164 70 20 CGID COC[C@@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)C1CC1 161284552 DGBJLQJNVGJAHS-XHDPSFHLSA-N 295.810 3.060 70 20 CGID CC(C)(C(=O)N[C@@H]1CCC[C@@H](N)C1)c1ccccc1Cl 161285068 PGKFSHMIVCRKJR-VXGBXAGGSA-N 294.826 3.004 70 20 CGID CCCC(=O)N(CCC)[C@H](C)C(=O)Nc1ccccc1 161442735 HLLJZCMKYVLYPE-CYBMUJFWSA-N 276.380 3.052 70 20 CGID COCC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1 160456215 GXXBVCWVABPFGH-UHFFFAOYSA-N 296.326 3.004 70 20 CGID CCCN(Cc1ccccc1)Cc1cc(C(N)=O)cs1 160481354 LIAMLGNVRPCFKA-UHFFFAOYSA-N 288.416 3.259 70 20 CGID C[C@H](NC(=O)NC1CCCCC1)c1ccsc1 160525601 IBDAVBVBRXXHEW-JTQLQIEISA-N 252.383 3.441 70 20 CGID CC[C@H](NC(=O)c1cc(C(C)C)[nH]n1)c1c(C)noc1C 160544819 KCBJMWRIODVMRB-NSHDSACASA-N 290.367 3.019 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ncnc2oc(C)c(C)c12 160548221 ZXOKNLJHXXAFDJ-BONVTDFDSA-N 273.336 3.214 70 20 CGID CC[C@@H](N[C@H](CN1CCCC1=O)c1ccccc1)C1CC1 160772597 ZPBDHNKZSDDLTN-IAGOWNOFSA-N 286.419 3.128 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CC[C@H](O)CC2)c(Cl)c1 159850969 ZWYOPEHGGJTONX-PHIMTYICSA-N 282.771 3.073 70 20 CGID Cc1cc(NC(=O)[C@H]2C[C@@H]2c2sccc2C)no1 159918332 BLYIEQLPNFMPIC-UWVGGRQHSA-N 262.334 3.095 70 20 CGID C[C@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1 216904253 LEBXSZCIQYVDMP-SMDDNHRTSA-N 287.325 3.471 70 20 CGID CCOC(CCN[C@@H](C)CCc1ccccc1)OCC 159541009 MTHZKTHAYZSEML-HNNXBMFYSA-N 279.424 3.387 70 20 CGID CCC[C@H](O)CNCc1ccc(F)c(C(F)(F)F)c1 160149006 KTCWSIAOBXIIBA-JTQLQIEISA-N 279.277 3.095 70 20 CGID C[Si](Cl)(Cl)c1ccc(Br)cc1 196239297 AENZMDFLCQPYRJ-UHFFFAOYSA-N 270.029 3.206 70 20 CGID C[C@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)C1CC1 161021345 ODMNHTZWNOPZLP-GXTWGEPZSA-N 265.397 3.031 70 20 CGID COCCC1(CNC(=O)N(C)C2CCC(C)(C)CC2)CC1 161163863 LWZKXAZDEAFVSO-UHFFFAOYSA-N 296.455 3.413 70 20 CGID CC1(C)C[C@H](NC(=O)NCCCC2CCCC2)CCO1 161444665 CPTCFURAEKUQLF-CQSZACIVSA-N 282.428 3.214 70 20 CGID COC(=O)c1cccc(NC(=O)N[C@H](C)CC(C)C)c1 160014873 IKMCVQXKSSEADQ-LLVKDONJSA-N 278.352 3.029 70 20 CGID CC[C@H](NC(=O)CC1CCCC1)c1c(C)noc1C 160383582 TWKYRQHKUIQVCT-ZDUSSCGKSA-N 264.369 3.439 70 20 CGID COCC(C)(C)C(=O)Oc1cccc(C(F)(F)F)c1 160509874 NTSMIKZDZMCRIA-UHFFFAOYSA-N 276.254 3.283 70 20 CGID O=C(CCC1CC1)N[C@H]1CCOC2(CCCCC2)C1 160539465 BTUFOGRNNUGTTN-AWEZNQCLSA-N 265.397 3.175 70 20 CGID Cn1nccc1CN1CCC[C@@H]1c1nc2ccccc2s1 160712764 VNYHIYVKVMRBHL-CQSZACIVSA-N 298.415 3.367 70 20 CGID CCCC[C@H](CCC)NC(=O)c1cnc2c(c1)ncn2C 160717055 AZPPZKJVGDMKEY-ZDUSSCGKSA-N 288.395 3.057 70 20 CGID COCCOc1ccc(NC(=O)[C@@H]2CC2(C)C)c(C)c1 159458892 SZWIDGSQRHILRB-ZDUSSCGKSA-N 277.364 3.005 70 20 CGID CCCCn1ncc(C(=O)Nc2ncc(Cl)s2)c1C 159729630 FMISEBGMQQQBBD-UHFFFAOYSA-N 298.799 3.354 70 20 CGID CCCCn1ncc(NC(=O)N2C[C@H]3CCC[C@H]3C2)c1C 159920874 IESGLLGLXPJSSI-OKILXGFUSA-N 290.411 3.255 70 20 CGID Cc1noc(C)c1CCS(=O)(=O)[C@@H](C)c1ccccc1 159571690 WIDQMPZCCWKBLL-ZDUSSCGKSA-N 293.388 3.010 70 20 CGID CCS[C@H]1CCC[C@@H]1Nc1ncnc2c1CCCC2 217811661 QRNKXZMRHSFBDW-KBPBESRZSA-N 277.437 3.442 70 20 CGID CCc1nnc(N[C@@H]2CC[C@H](C)[C@@H](C)C2)nc1CC 218132014 OSDLCLDLFCBSHN-SDDRHHMPSA-N 262.401 3.233 70 20 CGID CN(Cc1ccc(C(F)(F)F)cc1)C[C@H]1CCC[C@@H]1O 159662870 MYXOBCSGNRSRLO-OCCSQVGLSA-N 287.325 3.298 70 20 CGID FC(F)(F)c1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)cc1 217654492 VJSSOMRHRWVQMD-CABCVRRESA-N 298.352 3.422 70 20 CGID CC[C@@H](c1ccncc1)N(C)CCCN1CCCCC1 161461041 FHADZRMHAIFIRH-KRWDZBQOSA-N 275.440 3.341 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCCc3occc32)cn1 161385398 JCNKOAJLHRMIQD-CYBMUJFWSA-N 271.320 3.182 70 20 CGID CCCC(O)(CCC)CC(=O)N1Cc2ccccc2C1 161455059 YWNQQXZRACEDBR-UHFFFAOYSA-N 275.392 3.250 70 20 CGID CSC[C@@H](CCO)N[C@H](C)c1cc(C)sc1C 160181671 DASFUPJPJNDKJS-ZYHUDNBSSA-N 273.467 3.130 70 20 CGID CCNC(=O)c1cccc(CNC2[C@@H](C)CCC[C@H]2C)c1 160187188 VMESGOGNBOTQNQ-VMZNBEPHSA-N 288.435 3.351 70 20 CGID CC(C)n1cccc1C(=O)NCCc1cccs1 160540890 RBBPLHRFFDMJNO-UHFFFAOYSA-N 262.378 3.103 70 20 CGID CC(C)c1ccc(C(=O)NC(C2CC2)C2CC2)cn1 160581924 HXORBGMLFQSZHK-UHFFFAOYSA-N 258.365 3.123 70 20 CGID C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)C1CCC(C)(C)CC1 160654664 JMPJPUMRWDLBRD-ZFWWWQNUSA-N 280.456 3.001 70 20 CGID O=C(CCOc1ccccc1)N1CCc2c(F)cccc2C1 160784072 CSSUHGQTWKLLRQ-UHFFFAOYSA-N 299.345 3.180 70 20 CGID CCCN(CCC)C(=O)Nc1cc(C(=O)OC)cs1 160927054 ZHZLJQYAPNLTGL-UHFFFAOYSA-N 284.381 3.189 70 20 CGID CS[C@@H](C)CC(=O)Nc1cc(-c2nnco2)ccc1C 159554155 JZCNYPZDSSANOC-JTQLQIEISA-N 291.376 3.125 70 20 CGID CC1(C(=O)NCCc2cc3ccccc3[nH]2)CCC1 159596291 SFXLJIRPHRJEFX-UHFFFAOYSA-N 256.349 3.017 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1ccc(F)cc1F 160079464 QFODEDXSFKEGQS-NEPJUHHUSA-N 270.367 3.346 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)c(F)c1 161016250 YQRBXJWLMRNFDO-MJBXVCDLSA-N 294.414 3.358 70 20 CGID COc1cc(Cl)ccc1C(=O)N1[C@@H](C)CC[C@@H]1C 161389956 UTUXEWRMDJKATN-UWVGGRQHSA-N 267.756 3.362 70 20 CGID Cc1cccc(OCCn2nc(C3CC3)nc2C2CC2)c1 161458622 SNVFIEDTLAIDOK-UHFFFAOYSA-N 283.375 3.420 70 20 CGID CN(Cc1ccccc1N1CCCC1)C(=O)C1(C)CC1 160017662 JHLMGACMPQAIRL-UHFFFAOYSA-N 272.392 3.045 70 20 CGID Cc1noc(C)c1CCSCc1nccs1 160159765 YUIMVRIOFYYWHF-UHFFFAOYSA-N 254.380 3.224 70 20 CGID CC(C)[C@H](C)NC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 160375289 RBSLJXBQJDIUHX-WFASDCNBSA-N 292.379 3.020 70 20 CGID CC1(C)C[C@H]1C(=O)N(Cc1ccccc1)C[C@H]1CCCO1 160600946 CBHXVERXXHJZJQ-CVEARBPZSA-N 287.403 3.240 70 20 CGID CCCCn1ncc(NC(=O)N(C)CCC2CC2)c1C 160641417 GQJLDYLIWDNQKA-UHFFFAOYSA-N 278.400 3.255 70 20 CGID CC[C@@H](NCCOCC(C)C)c1ccc2c(c1)OCCO2 160690196 AHUDDAXOMAEHKX-OAHLLOKOSA-N 293.407 3.171 70 20 CGID Cc1ccnc(-c2ccc(NC(=O)NC3CC=CC3)cc2)n1 160719860 GCQAGZYDNCQICE-UHFFFAOYSA-N 294.358 3.292 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@](C)(CC)C1 159826895 PSDNHKUNSZKDHL-HNNXBMFYSA-N 264.417 3.009 70 20 CGID O=C(NCC1(c2ccccc2)CC1)N1CCC2(CCC2)C1 159660512 VIAMLOZUZOURSK-UHFFFAOYSA-N 284.403 3.304 70 20 CGID CC(=O)Nc1cccc(CSc2ccncc2)c1 159954972 JZTJIKNTLOMTMO-UHFFFAOYSA-N 258.346 3.332 70 20 CGID COc1ccc2c(c1)C[C@H](N[C@@H]1CCCSC1)CC2 159566920 OWCZFDXOQTVKDJ-HUUCEWRRSA-N 277.433 3.038 70 20 CGID CCC[C@@](C)(NC(=O)c1ccc(Cl)cc1C)C(=O)OC 160746453 OBPXUTKHPXCRTQ-OAHLLOKOSA-N 297.782 3.110 70 20 CGID O=C(NCCCc1ccccc1)N1[C@H]2C=CC[C@H]1CC2 218754703 VGNLYLFLRGWQPC-HOTGVXAUSA-N 270.376 3.122 70 20 CGID COc1ccc(C(=O)N(C)C2CCCCC2)c(F)c1 218442480 DPGBPICACMBACC-UHFFFAOYSA-N 265.328 3.239 70 20 CGID CC(C)(C)c1noc(-c2cc(F)c(F)cc2F)n1 161256484 ITDUVTBIDZWDDM-UHFFFAOYSA-N 256.227 3.451 70 20 CGID CCCn1c(C)nnc1CSCc1c(C)noc1C 161260946 YCQKHDCOZPDJIF-UHFFFAOYSA-N 280.397 3.035 70 20 CGID Cc1nc(C2(NCc3ccc(F)cc3)CCCC2)no1 161367014 HWGISHPSGNSYGC-UHFFFAOYSA-N 275.327 3.076 70 20 CGID CCc1c(C(=O)NCC2(C3CC3)CC2)cnn1CC(C)C 161477996 BGMFPTQYTYZZKV-UHFFFAOYSA-N 289.423 3.022 70 20 CGID c1ccn2c(CN3CCC4(CCCC4)CC3)cnc2c1 160553115 ARJSFYIBCWMXHZ-UHFFFAOYSA-N 269.392 3.491 70 20 CGID CC[C@H](NCCCCC(=O)OC)c1ccc(F)cc1F 160832375 MZMACCDUPWDGFU-AWEZNQCLSA-N 285.334 3.349 70 20 CGID CC[C@@H](NC(=O)Nc1cc(F)ccc1C)[C@@H]1CCCO1 159405349 SOLMXLUYXPZGDC-OCCSQVGLSA-N 280.343 3.213 70 20 CGID Cc1ccc([C@@H](C)NC(=O)NCCc2ccncc2C)cc1 159668043 SNEXRIVICFZOSQ-OAHLLOKOSA-N 297.402 3.301 70 20 CGID CO[C@H](C)CC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 159917069 CROQVEVUUHTREV-KDOFPFPSSA-N 298.386 3.021 70 20 CGID CCCc1noc(CCCC(=O)N[C@H]2CCC[C@H]2CC)n1 159557441 MRTNTROEYAQGPO-OLZOCXBDSA-N 293.411 3.040 70 20 CGID Cc1cccc(C(=O)NCc2cccc(CO)c2)c1Cl 160380984 JCYXBKFHMUYSFP-UHFFFAOYSA-N 289.762 3.071 70 20 CGID C[C@H]1CCCN(C(=O)N(C)c2ccc(F)cc2)C1 160481628 TXKFDHXSIXTYLW-NSHDSACASA-N 250.317 3.114 70 20 CGID CC[C@@H](SCCN1CCOCC1)c1ccc(F)cc1 160034495 PICZZHCCJBLRNJ-OAHLLOKOSA-N 283.412 3.342 70 20 CGID CO[C@@]1(CN[C@H]2CCC(C)(C)c3ccccc32)CCOC1 160101536 NWOBYKQKTQAEMM-FUHWJXTLSA-N 289.419 3.194 70 20 CGID CS[C@@H](C)CC(=O)N[C@@H]1CCCc2sccc21 160201125 JJJPNBOEWVRGQI-GXSJLCMTSA-N 269.435 3.383 70 20 CGID O=C(CCC1CCCC1)CSc1nnc(C2CC2)[nH]1 160212614 PQXOSYMTULTXLL-UHFFFAOYSA-N 279.409 3.314 70 20 CGID CC1(NC(=O)NCC(C)(C)c2ccc(F)cc2)CCC1 160703978 MQNAUKNITKYLAP-UHFFFAOYSA-N 278.371 3.345 70 20 CGID CC(C)(C)SCCCC(=O)N1CC[C@@H]2OCCC[C@H]2C1 160740467 RXPWPRFMEDPJAM-KBPBESRZSA-N 299.480 3.326 70 20 CGID CCCC1(CN[C@@H](C(=O)NC2CC2)c2ccccc2)CC1 160771929 LDJFGOPLTVXLOI-MRXNPFEDSA-N 286.419 3.176 70 20 CGID CC[C@H](NC(=O)C[C@@H](C)c1ccncc1)c1ccncc1 160784566 LKFSKDAOEQPGOM-CJNGLKHVSA-N 283.375 3.238 70 20 CGID COc1ncccc1NC(=O)c1cc(F)cc2cccnc12 160795008 BUTVIJVIAPOLDJ-UHFFFAOYSA-N 297.289 3.030 70 20 CGID CN(C)Cc1ccc(CN[C@H]2CC(C)(C)OC2(C)C)cc1 160892522 HZLZQKCUUBJJGQ-INIZCTEOSA-N 290.451 3.184 70 20 CGID Cc1ccccc1NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160928784 PHRVJTDQIUQRGP-HIFRSBDPSA-N 274.364 3.074 70 20 CGID CCO[C@@H](CCNC(=O)C[C@@H](C)c1ccncc1)C(C)C 160971173 IFSGPFJQXLPAPQ-ZBFHGGJFSA-N 292.423 3.143 70 20 CGID CCc1noc(C)c1CNc1ccn(-c2ccccc2)n1 159402903 JKDBRDVVHULWHW-UHFFFAOYSA-N 282.347 3.343 70 20 CGID CCC(CC)NC(=O)[C@@H](C)N[C@@H](C)c1cccc(F)c1F 159424588 SRMHIJJZWCQBOE-WDEREUQCSA-N 298.377 3.309 70 20 CGID COc1ccc(N(C)C(=O)Cc2cccc(C)c2)cc1F 159821543 QDVSBBAXPCEERT-UHFFFAOYSA-N 287.334 3.348 70 20 CGID CCc1noc(C)c1CSCc1nc([C@@H](C)OC)no1 159825235 VLODCDOFOTYVGC-SECBINFHSA-N 297.380 3.069 70 20 CGID CCOc1ccccc1NC(=O)N[C@@H](C)C1CCC1 159456099 GSFFHBXPJGBUAR-NSHDSACASA-N 262.353 3.395 70 20 CGID CCCNC(=O)Nc1cccc(N2CCC(C)CC2)c1 159687301 HQXKMNKQTAOMKN-UHFFFAOYSA-N 275.396 3.454 70 20 CGID CC(C)CC1(CNC(=O)NC2C[C@@H](C)O[C@H](C)C2)CCC1 159917405 GCBZSQYHLLQQKU-ZIAGYGMSSA-N 296.455 3.458 70 20 CGID Cc1cccc(CNC(=O)N2CCC3(CCC3)C2)c1 159975148 RAASSKVFWQFAMZ-UHFFFAOYSA-N 258.365 3.081 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCN3CCCC[C@@H]23)cc1F 217666624 CVJPDNMNBFYHAI-MAZHCROVSA-N 292.398 3.112 70 20 CGID C[C@H](NC[C@H]1CCc2ccccc21)C1CCN(C)CC1 161006617 NLCMNHKDHRLWLF-WMLDXEAASA-N 272.436 3.036 70 20 CGID O=C(/C=C/c1ccco1)N[C@H]1CCOC2(CCCCC2)C1 161473355 JPWFZJRYMSNMQE-UZYOAWRESA-N 289.375 3.291 70 20 CGID CC(C)COC[C@H](NC(=O)NC1(C)CCC1)c1ccco1 160398492 HCUCEYOKXXYPRB-ZDUSSCGKSA-N 294.395 3.235 70 20 CGID O=C(O[C@H](c1ccccn1)C(F)(F)F)C1CCCC1 160459749 OJASNXODWTYSDS-LLVKDONJSA-N 273.254 3.418 70 20 CGID Cc1cc(Oc2ccc(NC(=O)c3ncoc3C)cc2)n[nH]1 160491062 FMNZGRJQGMTPCH-UHFFFAOYSA-N 298.302 3.059 70 20 CGID CCOc1ccc(NC(=O)C[C@@H](C)SC)c(C)c1 160518198 BKWPFKBDHCGIBM-LLVKDONJSA-N 267.394 3.474 70 20 CGID CC(C)(C)c1nc(CC(=O)Nc2cccc(F)n2)cs1 160634596 OKUFJWPLZWOUOM-UHFFFAOYSA-N 293.367 3.156 70 20 CGID C/C(=C\C(=O)N[C@@H]1CCOC2(CCCCC2)C1)C1CC1 160704780 RZCNKLKMTNAVLQ-HFBDAHEESA-N 277.408 3.341 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)OCc1cccnc1 159409416 KLOOOHORKINUAM-CHWSQXEVSA-N 273.357 3.298 70 20 CGID CCCCn1ncc(NC(=O)N[C@@H](C)C(C)C)c1C 159639188 OLZODMXPQVVAMT-NSHDSACASA-N 266.389 3.158 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1ccccn1 159508432 HDELJIBAKPQCQU-YNEHKIRRSA-N 286.400 3.432 70 20 CGID CCC(C)(CC)C(=O)Nc1cc(C)cnc1OC 159395167 DMIUGRYVSFXZMA-UHFFFAOYSA-N 250.342 3.163 70 20 CGID CCOC(CCN[C@@H](C)Cc1ccc(F)cc1)OCC 159545433 JCFTWKZKTPAPRX-ZDUSSCGKSA-N 283.387 3.136 70 20 CGID COc1cc(N[C@@H]2CCC[C@H]2[C@@H]2CCCN2)ccc1F 160040740 LZTAKDPIZFZEMJ-AEGPPILISA-N 278.371 3.167 70 20 CGID Cc1ccccc1C1CC(N[C@@H]2CCN3CCCC[C@@H]23)C1 217693400 OCXXZHFVXSMTEP-HWMSQKFYSA-N 284.447 3.457 70 20 CGID Cc1cc(OCCCCS(=O)(=O)Cl)ccc1Cl 100495502 QLHCQHREPCPQCB-UHFFFAOYSA-N 297.203 3.376 70 20 CGID Cc1ccc(CNC2(c3noc(C)n3)CCCC2)cc1 161369566 ZIIDQHFOAVVPDX-UHFFFAOYSA-N 271.364 3.246 70 20 CGID CNC[C@@H](C)C(=O)N(C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 161454766 IXQVOHXRHZDMOZ-UPJWGTAASA-N 296.842 3.146 70 20 CGID CC(C)c1ncc(C(=O)NCC2(C3CC3)CC2)s1 160010961 WGISYAOUGYESLL-UHFFFAOYSA-N 264.394 3.187 70 20 CGID CC[C@@H](SC)C(=O)O[C@@H](c1ccccn1)C(F)(F)F 160106221 SWNFVGRHKXGHAM-ZJUUUORDSA-N 293.310 3.370 70 20 CGID c1ccc2oc(N[C@H]3CCO[C@@H](C4CC4)C3)nc2c1 160319076 NEVJKAIEQJQXEZ-SMDDNHRTSA-N 258.321 3.197 70 20 CGID CC(C)c1nccc(N2CCC[C@@H]2CN2CCCCC2)n1 160435468 IJUPUHPRYCFCPM-OAHLLOKOSA-N 288.439 3.055 70 20 CGID Cc1ccoc1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160480390 WGNUKEJAXSGJHB-CYBMUJFWSA-N 277.364 3.200 70 20 CGID Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc(C)c(C)cc1C)CC2 160555974 FCJZLQSKWLULOW-HOCLYGCPSA-N 298.434 3.177 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CC[C@H](C)C[C@H]1C 160585942 FOAIDFGYZQYZKZ-NWDGAFQWSA-N 299.374 3.306 70 20 CGID C[C@@H](CCOc1ccccc1)C(=O)Nc1cccc(F)n1 160718138 WULSSDJIZJGLGH-LBPRGKRZSA-N 288.322 3.264 70 20 CGID CCO[C@H]1CCCN(C(=O)c2ccc(F)c(SC)c2)C1 160945564 QMFPWKNRTDHAPI-LBPRGKRZSA-N 297.395 3.189 70 20 CGID Cc1ccccc1[C@H](NC(=O)[C@@H](C)N)[C@H]1CCC[C@H](C)C1 159687849 FOTRFUYDDSBBKO-PWXKEOIMSA-N 288.435 3.326 70 20 CGID O=C(N[C@@H]1CCc2ccccc21)N1CCC2(CCC2)C1 159509307 OLUQYPVZRJKGFG-OAHLLOKOSA-N 270.376 3.260 70 20 CGID COCCC1(CNC(=O)N[C@H](C)c2ccccc2)CCC1 159529691 JEEJMJHFMWOIRI-CQSZACIVSA-N 290.407 3.254 70 20 CGID Cc1noc(C)c1CCNc1nc(C(C)(C)C)ns1 159381083 SSWIGLHYWSTEFK-UHFFFAOYSA-N 280.397 3.095 70 20 CGID CC1CCC(N(C)C[C@@H](O)Cc2ccccc2)CC1 218757732 VFYCVQDXOZULII-PREGVCBESA-N 261.409 3.101 70 20 CGID COc1cccc(Cl)c1CNCc1ccn(C(C)C)n1 217823100 ZJRRZGONGDDTFK-UHFFFAOYSA-N 293.798 3.416 70 20 CGID Cc1cc(C)nc(N[C@H]2CCCc3cc(N)ccc32)n1 159507085 ICEOLMDUFXXMCT-HNNXBMFYSA-N 268.364 3.165 70 20 CGID COc1ccc2c(c1)C[C@@H](NC[C@H](C)C1CC1)CC2 159555108 FRFMRLAXCUBWIP-LRDDRELGSA-N 259.393 3.188 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2c(N)cccc2Cl)O1 160788798 PCIJKGQGHZTLOX-VIFPVBQESA-N 283.755 3.037 70 20 CGID O=C(Nc1ccc(N2CCCCCC2)cc1)C(F)F 218441398 FQVBUEWKAAEKHW-UHFFFAOYSA-N 268.307 3.271 70 20 CGID OC1(CNC/C=C\c2ccccc2)CCCCCC1 217663893 OYYNCKQNDVDCQG-FLIBITNWSA-N 259.393 3.375 70 20 CGID CCN(CC(=O)Nc1c(F)cccc1F)CC(C)(C)C 160254397 YMWDXNJOROZIII-UHFFFAOYSA-N 284.350 3.271 70 20 CGID CC/C=C(/C)C(=O)N[C@H](C)CC(=O)c1ccc(F)cc1 161185839 UXBDBMPUWJLCTF-DKRCXCIFSA-N 277.339 3.260 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CC1CCOCC1 161238394 SDKIZCSVZNDIJO-LSDHHAIUSA-N 267.413 3.230 70 20 CGID CCOC(=O)[C@H]1CCCCN1Cc1cccc2[nH]ccc12 161282103 PNKOHYHPXMUWMQ-MRXNPFEDSA-N 286.375 3.086 70 20 CGID CN1CCC(N[C@@H]2CCC[C@@H]2c2ccccc2)CC1 161461232 ZXBFZSYTKRWLQW-IAGOWNOFSA-N 258.409 3.007 70 20 CGID CC(C)(C)c1nsc(Oc2ccc(F)nc2)n1 160040822 NQXJCQGAEAZKST-UHFFFAOYSA-N 253.302 3.162 70 20 CGID Cc1nc(CC(=O)Nc2cccc3[nH]ccc23)c(C)s1 160270809 DSEIUKLGPWVIHC-UHFFFAOYSA-N 285.372 3.422 70 20 CGID C[C@@H](NC[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1N(C)C 160599324 YUHCRGJAHCLAIT-XNJGSVPQSA-N 294.414 3.093 70 20 CGID Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cn[nH]c2)c1 160625758 JEIMWPRSMPAAML-HNNXBMFYSA-N 269.348 3.004 70 20 CGID CC[C@H](NC(=O)N(CC)CC)c1ccc(F)cc1F 159613585 LCWMEXGJMGFQJM-ZDUSSCGKSA-N 270.323 3.467 70 20 CGID C[C@H](NC(=O)[C@@H]1CCC[C@H](N)C1)c1ccc(F)cc1Cl 159626542 JGFRENDNLQTPKK-UMNHJUIQSA-N 298.789 3.174 70 20 CGID CCC[C@@H](C(=O)N[C@@H](CCO)c1ccccc1)C(C)C 159516501 XRNSKETUQJAEQZ-CVEARBPZSA-N 277.408 3.299 70 20 CGID CC[C@H](C)[C@@H](C)N(C(=O)NCCc1cscn1)C1CC1 159551445 TWFAHKICDQGPIQ-NWDGAFQWSA-N 295.452 3.294 70 20 CGID CC[C@H](O)CCNC(=O)[C@H](c1ccccc1)[C@@H](C)CC 218095199 LALIVICMCSUGSA-BPUTZDHNSA-N 277.408 3.094 70 20 CGID CSc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159477005 JZDBZMMZYIOQDX-XHSDSOJGSA-N 289.444 3.456 70 20 CGID COc1ccc([C@H](C)NC[C@H]2CCC(C)(C)O2)cc1 160310536 WITLAQFFODSSDJ-SWLSCSKDSA-N 263.381 3.303 70 20 CGID CCN(CCCS(=O)(=O)C(C)C)c1ccccc1C 160951609 DICRLNGFEYGHSY-UHFFFAOYSA-N 283.437 3.035 70 20 CGID CCN(CC)CCCNC(=O)Nc1ccc(C)c(C)c1 217310733 DTJYTNLUQIUJAC-UHFFFAOYSA-N 277.412 3.157 70 20 CGID CCOCCCSCc1ccc(C(=O)OC)s1 159811909 MSBILINHAAWYAV-UHFFFAOYSA-N 274.407 3.195 70 20 CGID Cc1c(C(=O)N[C@@H]2CCC[C@H](N)C2)oc2c(C)cccc12 161063208 MSWIBFBJDRVHHY-QWHCGFSZSA-N 286.375 3.049 70 20 CGID CCCC[C@@H](CC)CC(=O)N[C@@H](CO)CC(C)C 160642781 AQCCKRMQHZCLDQ-ZIAGYGMSSA-N 257.418 3.116 70 20 CGID CCC(CC)C(=O)N[C@@H]1CCc2c(OC)cccc21 160112214 DMDSHGFYOROSIV-CQSZACIVSA-N 261.365 3.235 70 20 CGID CC(C)n1nccc1C(=O)NCc1ccc(F)c(Cl)c1 160305534 XUHJCDLNUWFJDV-UHFFFAOYSA-N 295.745 3.187 70 20 CGID Cc1cccc2nc(CN[C@H](C)c3cncc(F)c3)cn12 160327594 ONZLLGJJXZYCEE-GFCCVEGCSA-N 284.338 3.028 70 20 CGID CCOCCC1(CNC(=O)N[C@H](C)CC2CC2)CCCC1 160407236 ACRAYUNTXMVANX-CQSZACIVSA-N 296.455 3.461 70 20 CGID CC(C)c1cc(=O)n(Cc2ccc(Cl)cc2)cn1 160652888 BBYVVZLFMMRSDQ-UHFFFAOYSA-N 262.740 3.068 70 20 CGID CCC(=O)c1cccc(NC(=O)Cc2ccccc2O)c1 160750633 CDFSVUAHPOFHNA-UHFFFAOYSA-N 283.327 3.166 70 20 CGID Cc1cccc(C)c1NC(=O)CN(C)C[C@H]1C[C@H]2C=C[C@H]1C2 160921669 NSXWJZSHTZFOQH-YESZJQIVSA-N 298.430 3.386 70 20 CGID CC[C@H](NC(=O)Nc1ccc(C)c(F)c1)[C@H]1CCCO1 159418436 MKZFSGPPEKXGPA-UONOGXRCSA-N 280.343 3.213 70 20 CGID CC[C@H](C)OCC(=O)N(C)Cc1cc2ccccc2o1 159928876 ISMFSCRYQGSLSQ-LBPRGKRZSA-N 275.348 3.206 70 20 CGID CCCCO[C@H]1C[C@@H](N[C@@H](C)c2cnccn2)C1(C)C 159779873 VGDHVDUZIMSQFN-CFVMTHIKSA-N 277.412 3.111 70 20 CGID COCC[C@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C(C)C 161037996 BMYMPXSYWXMLRJ-SUMWQHHRSA-N 293.407 3.170 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)c2ccc(C)o2)o1 161214044 OURYEZCHGOSQCH-CYBMUJFWSA-N 289.331 3.305 70 20 CGID O=C(NCc1ncccc1F)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 161322719 HQLVJPGICIETHR-BFHYXJOUSA-N 290.382 3.443 70 20 CGID CCC1(CNC(=O)C[C@H](C)c2ccncc2)CCC1 161422621 JGRQUEZJQZBWNU-ZDUSSCGKSA-N 260.381 3.272 70 20 CGID CC[C@H](NCCNC(=O)C1CC1)c1cccc(Cl)c1F 161494666 DIWFJEQTKYGVGB-ZDUSSCGKSA-N 298.789 3.046 70 20 CGID CCCCCOCC(=O)N[C@@H]1CCc2c(OC)cccc21 160133096 KCZQUXHIFQVXSZ-OAHLLOKOSA-N 291.391 3.006 70 20 CGID CCOc1cc(NC(=O)C[C@H](C)SC)ccc1OC 160135497 AVIMLSGHZSHOCG-JTQLQIEISA-N 283.393 3.174 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nn1cnc2ccccc21 160385452 JJXFSSXETQJUPU-VXGBXAGGSA-N 297.383 3.280 70 20 CGID CC(=O)c1c(F)cccc1N[C@H]1CCO[C@@H](C2CC2)C1 160413259 BWZAGASVOJMCNS-SWLSCSKDSA-N 277.339 3.398 70 20 CGID CC(C)CCS(=O)(=O)N1CCC2(CCCC2)CC1 160600234 VRCVDMUBYWEQDI-UHFFFAOYSA-N 273.442 3.019 70 20 CGID Cn1ccnc1CN1CCC[C@H]1c1cccc(Cl)c1 160810803 JZKNQQMHCYLPFK-AWEZNQCLSA-N 275.783 3.411 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CC(F)(F)F 160935018 OVNOVYXRQZFLSM-ZJUUUORDSA-N 251.292 3.366 70 20 CGID CC[C@@H](N[C@H]1CCCSC1)c1ccc2c(c1)OCCO2 159556888 YGBSUAIOLFGNOK-UONOGXRCSA-N 293.432 3.394 70 20 CGID Cc1cc(C(=O)CN(C)[C@H]2CCC[C@@H](C)C2)c(C)n1C 218588137 HDYKNLQWWFLFHA-DOMZBBRYSA-N 276.424 3.335 70 20 CGID CCOc1cc2c(cc1CN[C@H]1CCSC1)O[C@@H](C)C2 218606481 UQZHDFVWEFLYFG-FZMZJTMJSA-N 293.432 3.004 70 20 CGID NC(=O)c1ccc(F)c(NCc2cc(F)cc(Cl)c2)c1 160855852 WQHJYDAULQZCLC-UHFFFAOYSA-N 296.704 3.329 70 20 CGID CCCCC1CCC(C(=O)NC(C)(C)CCO)CC1 161505142 LWRQBLHQJXRZFH-UHFFFAOYSA-N 269.429 3.260 70 20 CGID COC[C@H](NC(=O)Nc1cc(F)cc(Cl)c1)C1CC1 161077277 MPZZEMCUAZFQBB-LBPRGKRZSA-N 286.734 3.026 70 20 CGID CCc1ccccc1NC1CCC(NC(C)=O)CC1 161077536 XJILRZJLRHOEGQ-UHFFFAOYSA-N 260.381 3.108 70 20 CGID CC[C@H](CC1CCCC1)C(=O)N[C@H](CO)CC(C)C 161079933 HLTRMHFTTNROQK-CABCVRRESA-N 269.429 3.116 70 20 CGID Cc1cc(C)cc(C[C@@H](C)NC(=O)CNc2ccccc2)c1 161347866 YMJPKQVPNDRFGL-MRXNPFEDSA-N 296.414 3.463 70 20 CGID CCc1nc(CN[C@H](c2ccc(F)cc2F)C(C)C)n[nH]1 160503520 KQIORIZXKQJNMQ-HNNXBMFYSA-N 294.349 3.132 70 20 CGID O=C(CCN1CC[C@@H]2CCCC[C@@H]21)Nc1cccc(F)c1 160560293 WALPZAVMCKHTOE-BBRMVZONSA-N 290.382 3.419 70 20 CGID CC(C)(C)[C@@H]1CCN(C(=O)CC[C@@H](N)c2ccccc2)C1 159500926 ZMBILOBNFGLLGL-HZPDHXFCSA-N 288.435 3.361 70 20 CGID CS[C@@H](C)CC(=O)NCCc1ccc(Cl)s1 159906977 QXRKFYVEZNGREP-QMMMGPOBSA-N 277.842 3.202 70 20 CGID CC[C@H](OC1CCCCC1)C(=O)NCCCOCC(C)C 159712883 QALXKASSSZDTFB-INIZCTEOSA-N 299.455 3.293 70 20 CGID CCC(CC)S[C@@H]1CCCN(CC(F)(F)F)C1=O 159718505 GAYUCLBQUZMGFF-SNVBAGLBSA-N 283.359 3.462 70 20 CGID CCC(C)(C)NC(=O)[C@H](C)N[C@H](C)c1cccc(F)c1F 159533974 JVFHLQNGMMCJHH-MNOVXSKESA-N 298.377 3.309 70 20 CGID CCOc1ccc(NC(=O)NOCC(C)C)c(C)c1 159383307 YAIRVKSWGOWXDB-UHFFFAOYSA-N 266.341 3.103 70 20 CGID Clc1ccccc1C[C@@H]1CCCN1CCn1ccnc1 159774120 YFVDANGYSNKYQN-HNNXBMFYSA-N 289.810 3.244 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCc1ccccc1C 217313767 FYKGCGFRKVUGPP-OAHLLOKOSA-N 260.381 3.469 70 20 CGID CCN(C(=O)NCC1(CCOC)CC1)C1CCCCC1 161016283 NJDCPNNMRMDKJN-UHFFFAOYSA-N 282.428 3.167 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@]2(C)CC)n1 161023916 HJNGKCOFPMYWRT-SJKOYZFVSA-N 298.390 3.409 70 20 CGID CC[C@H](C)[C@@H](C)N(C(=O)NCC1(CCOC)CC1)C1CC1 161147552 OTYQMACHWQJJRG-UONOGXRCSA-N 296.455 3.412 70 20 CGID Cc1cccc(C(=O)NCCCOc2ccccc2)c1F 161423060 SXELJCBSWHEMHH-UHFFFAOYSA-N 287.334 3.333 70 20 CGID CCC(CC)n1ncc(C(=O)N(C)CC2CC2)c1C 160308023 AEJHEPKEBJJLDN-UHFFFAOYSA-N 263.385 3.035 70 20 CGID CSC[C@H](CCO)N[C@@H](C)c1cc(C)c(C)cc1C 160406127 OXUFSHUUFPSHBI-GJZGRUSLSA-N 281.465 3.376 70 20 CGID CC[C@H](C)CS(=O)(=O)N(C)c1cccc(SC)c1 160438086 UDCIZKPHSNARMG-NSHDSACASA-N 287.450 3.221 70 20 CGID CS[C@H](C)CC(=O)NCCCCN(C)c1ccccc1 160851863 GVDPGKSYVPORPC-CQSZACIVSA-N 294.464 3.161 70 20 CGID CCN(Cc1ccccc1)C(=O)Cc1c(C)noc1Cl 159434068 PJJRWHMIICGPCB-UHFFFAOYSA-N 292.766 3.228 70 20 CGID CC(C)[C@H](O)CNC(=O)CCc1ccc(C(C)(C)C)cc1 159734517 SJUUSOFBMCELIL-MRXNPFEDSA-N 291.435 3.050 70 20 CGID CCOc1ccc(NC(=O)NCC(CC)(CC)CO)cc1 159746446 AGEYGMALUVPRLY-UHFFFAOYSA-N 294.395 3.006 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(C)n(CC)c1C 159577416 TUVZHTMGMCISSN-ZFWWWQNUSA-N 262.397 3.433 70 20 CGID CN(CC(=O)OCc1ccccc1)c1ccc(F)cc1 217005160 VBAYMMAWIDBTIC-UHFFFAOYSA-N 273.307 3.005 70 20 CGID CC[C@@H](C)C(=O)N(Cc1ccccc1)CC1(O)CCCC1 161239472 HPNUJBHKMADNMJ-OAHLLOKOSA-N 289.419 3.366 70 20 CGID COc1ccc(NC(=O)C[C@@H]2CC[C@@H](C)C2)cc1N 161249132 POBFBBAMAOZFLM-GHMZBOCLSA-N 262.353 3.042 70 20 CGID CCCCn1ncc(NC(=O)N2CC[C@H](CC)C2)c1C 160274043 KQUNASAVIALTMZ-ZDUSSCGKSA-N 278.400 3.255 70 20 CGID CC[C@@H](C)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 160497885 NGXFMCXJSYTORX-CYBMUJFWSA-N 268.445 3.001 70 20 CGID C[C@H](c1cccc(Br)c1)N(C)C[C@H](O)C1CC1 160774575 RJRIDLRRQPUELS-YGRLFVJLSA-N 298.224 3.213 70 20 CGID CC(C)[C@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 160988614 PDMJOGAOQKUYLA-UFBFGSQYSA-N 289.206 3.154 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cnc(-c2ccccc2)nc1 159555320 QUDQSTIYNMWTBP-BBRMVZONSA-N 295.386 3.452 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H]2CCN(C)[C@H](C)C2)C1 159377468 ZERAIUAXYKNGKX-BARDWOONSA-N 270.486 3.123 70 20 CGID CCC(C)(C)NC(=O)Nc1ccn(CCC(C)C)n1 159974284 WYFJQCPIDUPRPI-UHFFFAOYSA-N 266.389 3.239 70 20 CGID CCC[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cl 88251369 WTSVRIQHTAXBNY-SNVBAGLBSA-N 277.729 3.005 70 20 CGID CC[C@H]1CCCC[C@@H]1NCc1cccc(C(=O)NC)c1 161415569 TWWAXJLJVDUFDO-HOCLYGCPSA-N 274.408 3.105 70 20 CGID CCC[C@@H](C(=O)N1CC(=O)N(C)c2ccccc21)C(C)C 160121406 OEABEFTYILVAOG-CYBMUJFWSA-N 288.391 3.068 70 20 CGID CC(Cl)(Cl)C(=O)N[C@@H]1CCCc2sccc21 160203883 JOJTZCXPWIIXCK-MRVPVSSYSA-N 278.204 3.436 70 20 CGID COc1ccc(N(C)C(=O)CC(C)C)cc1Cl 160256043 OEOYBMRIIPTKNC-UHFFFAOYSA-N 255.745 3.358 70 20 CGID CCCCCc1nnc(NC(=O)C[C@H](C)SC)s1 160753088 MYLBAGOOPJQEPY-VIFPVBQESA-N 287.454 3.351 70 20 CGID C[C@H]1CC[C@@H](CCC(=O)N2CCc3c(F)cccc3C2)O1 160977416 QURJGRFMHMBNME-JSGCOSHPSA-N 291.366 3.058 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(NC(C)=O)ccc1OC 159370047 ANCVNWTULMOVLA-WBMJQRKESA-N 290.363 3.028 70 20 CGID O=S(=O)(Cl)c1cc(-c2ccccc2)cs1 106659219 JCOGEEUZNXSGIT-UHFFFAOYSA-N 258.751 3.343 70 20 CGID Cc1ccc(CN[C@H](C)CSC(C)(C)C)cn1 161291703 IYKORIVSQFIEDN-GFCCVEGCSA-N 252.427 3.400 70 20 CGID CCCCCCNC(=O)NCCc1ccc(OC)cc1 218761859 YBWSUGLPABXNHE-UHFFFAOYSA-N 278.396 3.117 70 20 CGID O=S(=O)(Cl)C[C@@H](F)c1ccc(F)cc1Cl 1537958815 MXPVISACEQXOJB-MRVPVSSYSA-N 275.103 3.058 70 20 CGID Cc1cccc(C(=O)Nc2nc3c(s2)CCC3)c1F 161420554 HHFHACWZNMEKRF-UHFFFAOYSA-N 276.336 3.332 70 20 CGID CC(C)[C@@H](NCc1ccccc1N1CCOCC1)C1CC1 161472693 NQGNHMIGSRRUQI-GOSISDBHSA-N 288.435 3.047 70 20 CGID CC(C)c1ccc(OCCN[C@@H](C)c2cnn(C)c2)cc1 160333658 BPBCIGVYODKEDP-AWEZNQCLSA-N 287.407 3.273 70 20 CGID CCN1CCC(NC(=O)C[C@H]2CCCC(C)(C)C2)CC1 160336495 VMYZJIIGNJJPSB-CQSZACIVSA-N 280.456 3.193 70 20 CGID CC(C)(C)O[C@H](C(=O)NCCCF)c1ccccc1 160457221 WQFLVMZARSYMAG-ZDUSSCGKSA-N 267.344 3.019 70 20 CGID CSc1cc(C(=O)Nc2cc(C)on2)ccc1F 160483967 DXSGCJKTZHQZSU-UHFFFAOYSA-N 266.297 3.096 70 20 CGID CCc1cc(O)nc(CN2CCC[C@H]2c2ccccc2)n1 160633713 XNZINYRZSAFGQW-HNNXBMFYSA-N 283.375 3.082 70 20 CGID CC[C@H](COC)NCCOc1cccc2ccccc12 160816012 XSGYRKNTQXMQDV-OAHLLOKOSA-N 273.376 3.233 70 20 CGID CCC[C@@H](C)CC(=O)N[C@@H]1CCOC2(CCCC2)C1 159662108 LAPFKBDZJBRPRF-ZIAGYGMSSA-N 267.413 3.421 70 20 CGID CCOc1cccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159493565 JSKLNQKMMYOZLF-BBWFWOEESA-N 287.403 3.133 70 20 CGID c1ccn2c(CN3CCC[C@H]3C3CCC3)cnc2c1 159698273 JTYAXRSUIJBGQD-HNNXBMFYSA-N 255.365 3.099 70 20 CGID CC[C@H](C(=O)Nc1ccnc2ccnn12)c1ccc(F)cc1 159726230 AUHXNNSPUKRVDS-ZDUSSCGKSA-N 298.321 3.001 70 20 CGID Cc1cc(C)c2cc(C(=O)Nc3c[nH]c(=O)c(C)c3)[nH]c2c1 159726493 QEPUKNXQGRITPK-UHFFFAOYSA-N 295.342 3.034 70 20 CGID CS[C@H](C)CC(=O)NCCCCOc1ccc(C)cc1 159968884 VTQYGFBZLWJMPT-CQSZACIVSA-N 295.448 3.412 70 20 CGID CC(C)[C@H](C)NCCC1CCN(CC(F)(F)F)CC1 159972905 IJCBCIQQHYGKDD-LBPRGKRZSA-N 280.378 3.285 70 20 CGID CCc1ncnc(NCc2ccc(F)c(F)c2)c1F 217990315 KALHYTSQGLXUPJ-UHFFFAOYSA-N 267.254 3.068 70 20 CGID C[C@@H]1C[C@H]1c1ccc(CNCCNC(=O)OC(C)(C)C)o1 218118134 GNIUMPNSCRORRY-DGCLKSJQSA-N 294.395 3.017 70 20 CGID O=S(=O)(CCC(F)(F)F)Cc1ccc(Cl)cc1 217061053 BLFHLBNBBDZZJS-UHFFFAOYSA-N 286.702 3.207 70 20 CGID Brc1cncc(CN[C@@H]2CC=CCC2)c1 160584616 NOXPURIOIVHLDX-GFCCVEGCSA-N 267.170 3.042 70 20 CGID CCc1noc(C)c1CSCCOCC1CC1 159810722 WVBJFPJCMPGFIU-UHFFFAOYSA-N 255.383 3.205 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)C(C)(C)F 160120250 TWOKJEPEBNHVSP-JTQLQIEISA-N 254.301 3.356 70 20 CGID CCCC[C@H](CC)CC(=O)N[C@H](CCO)C(C)C 160562025 RCNFUDPAVXBSLW-UONOGXRCSA-N 257.418 3.116 70 20 CGID CCC[C@@H](N)C(=O)N[C@H](c1ccccc1Cl)C(C)C 160830381 JVBCHCFQKXSEEA-KGLIPLIRSA-N 282.815 3.281 70 20 CGID C[C@@H]1CCN(C(N)=O)[C@H]1c1ccc(C(F)(F)F)cc1 160949686 WQOCEFBAFYJSPW-LDYMZIIASA-N 272.270 3.167 70 20 CGID C[C@H](CC(=O)Nc1cccc(F)c1)N[C@@H]1CCCSC1 159518003 JKPFASMPMGFWKO-BXUZGUMPSA-N 296.411 3.028 70 20 CGID CC[C@H](NC(=O)c1cc(Cl)ccn1)c1c(C)noc1C 159951690 ZWTAFPHPRUUIDJ-NSHDSACASA-N 293.754 3.221 70 20 CGID Cc1cccc(C)c1CN[C@@](C)(CO)c1ccccc1 217731413 QVRQUAVGGTXUIA-SFHVURJKSA-N 269.388 3.301 70 20 CGID CCC[C@H](C)CS(=O)(=O)N[C@@H]1CCCc2ccccc21 217181918 NOUSEBTXIZZNAT-XJKSGUPXSA-N 295.448 3.420 70 20 CGID CC[C@@]1(C)CCCN(CCCN2CCCCC2)C1 161311006 HMKNFICJMHZLQZ-INIZCTEOSA-N 252.446 3.375 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c1 161459082 MFPHCQAZGMMCIF-XHDPSFHLSA-N 287.359 3.223 70 20 CGID CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@]1(C)CC 160025593 ICXRCLZMHCSJRZ-GUYCJALGSA-N 289.375 3.200 70 20 CGID Cc1cccnc1NC(=O)c1ccc(C(C)C)nc1 160082863 XJELFKFLPTYVJP-UHFFFAOYSA-N 255.321 3.161 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)COC(C)(C)C 160195980 RFGGSOCYVWVTAW-LBPRGKRZSA-N 280.364 3.423 70 20 CGID COc1ccc(OC)c(Nc2nc(C)cs2)c1 160648139 ONKPLYOACSWNKN-UHFFFAOYSA-N 250.323 3.212 70 20 CGID Clc1cncc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160662174 PRMKPLNLGCXBPA-CHWSQXEVSA-N 289.766 3.462 70 20 CGID C[C@@H](c1nc([C@H]2CCOC2)no1)c1c(F)cccc1F 160888968 PUMGLZKWTWVOFZ-BDAKNGLRSA-N 280.274 3.004 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cccc(-n2cccn2)c1 159626635 RNSPQVMNRJOVDP-BBRMVZONSA-N 283.375 3.181 70 20 CGID CCC[C@H]1CN(C(=O)c2ccc(Cl)c(F)c2)CCO1 159458403 BUZWIFBBPQZZCW-NSHDSACASA-N 285.746 3.120 70 20 CGID CC[C@@H](NC(=O)Nc1c(C)cccc1C)[C@H]1CCCO1 159485431 MAFGFIXTZUPROC-ZIAGYGMSSA-N 276.380 3.383 70 20 CGID CCC[C@H](C)C(=O)N(C)c1ccc(OC)c(F)c1 159737860 MZFGRWUTBZJCMB-JTQLQIEISA-N 253.317 3.233 70 20 CGID O=C(NCCc1ccccc1F)Nc1cc(Cl)ccn1 217357510 IOBDKNRHYUHNAG-UHFFFAOYSA-N 293.729 3.238 70 20 CGID Cc1occc1CN(C)C(=O)N1CCCCCC1 160391581 ZMKLLINRDWLPDZ-UHFFFAOYSA-N 250.342 3.016 70 20 CGID CC[C@@H](C)OC[C@H](CS(=O)(=O)Cl)C(C)(C)C 114478376 LGKLWQAKOZVSKV-NXEZZACHSA-N 270.822 3.032 70 20 CGID COc1ccc([C@H](NC(=O)NC(C)C)C(F)(F)F)cc1 161499510 HVADAOYBQVNZNW-NSHDSACASA-N 290.285 3.006 70 20 CGID CC(C)Oc1ccc(CN[C@H]2CC(C)(C)OC2(C)C)cn1 160096118 IGOHZBRVVPROAM-AWEZNQCLSA-N 292.423 3.305 70 20 CGID CC[C@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@@H](C)O1 160263292 KHBBTSZLQPXXHX-OCCSQVGLSA-N 267.413 3.229 70 20 CGID C[C@H](O)CN(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 159477916 LGUMRMXDQZORHP-UWVGGRQHSA-N 261.287 3.079 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@H](C)C2CCC2)c1 159478740 TWJPFRCJMOZKAC-SNVBAGLBSA-N 250.317 3.444 70 20 CGID CN(CCCCNC(=O)NC1(C)CCC1)c1ccccc1 159894360 HFXLUAMTWYGHSE-UHFFFAOYSA-N 289.423 3.145 70 20 CGID CN(Cc1nccn1Cc1ccccc1)c1ncccc1F 159711781 BVRWTXYSKOECII-UHFFFAOYSA-N 296.349 3.102 70 20 CGID CCOc1ccccc1N(C)CC(=O)Nc1ccccc1C 159392388 UEAZIAXZYDZGHQ-UHFFFAOYSA-N 298.386 3.469 70 20 CGID CC(C)N(C)C(=O)CN1CCC[C@@H](C(C)(C)C)CC1 217224145 IBQHFBGAJMTLGH-CQSZACIVSA-N 268.445 3.001 70 20 CGID Cc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)c(C)c1 217639913 BIRAQLCPVXAGPZ-IRXDYDNUSA-N 258.409 3.020 70 20 CGID COc1cc(CNC2(C)CCC2)c(SC)cc1OC 159919320 WRIRKNLSVRFZTN-UHFFFAOYSA-N 281.421 3.458 70 20 CGID C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)F)cc1 864239104 XRUOWEKRZZEVGE-GXFFZTMASA-N 299.367 3.110 70 20 CGID CON(C)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 218121940 LPGQSCALJYICHA-DTWKUNHWSA-N 274.147 3.117 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2CC=CCC2)o1 161215401 SGKAGNAFKXKFPC-UKRRQHHQSA-N 289.375 3.446 70 20 CGID C[C@@H](c1ccccn1)N1CCO[C@H](CCc2ccccc2)C1 160278089 OCEJALXDSUSTOU-FUHWJXTLSA-N 296.414 3.476 70 20 CGID O=C(CCC(F)(F)F)N[C@H]1CCOC2(CCCCC2)C1 160315951 FKNLONMSYIVYEK-NSHDSACASA-N 293.329 3.327 70 20 CGID FC(F)(F)c1cccc(OCCN[C@@H]2CCSC2)c1 160492530 DOKRADRJXCFDFE-LLVKDONJSA-N 291.338 3.179 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CC[C@@H](C)C[C@@H]1C 160585829 FOAIDFGYZQYZKZ-NEPJUHHUSA-N 299.374 3.306 70 20 CGID CC[C@H](C)[C@@H](C)NC(=O)CSc1nc2ccccc2[nH]1 159777785 UIXCSOJKAYVWRK-WDEREUQCSA-N 291.420 3.206 70 20 CGID Cc1nccc(C(=O)N2C[C@@H](C)CSc3ccccc32)n1 159590849 HJXKGANQMYVURH-LLVKDONJSA-N 299.399 3.174 70 20 CGID CN(C[C@@H]1CCC[C@@H]1O)[C@@H]1CCCc2ccccc21 159477012 FIAGCPOQJISONY-UAGQMJEPSA-N 259.393 3.157 70 20 CGID Clc1ccc(NCc2cccc3cccnc23)nn1 159480536 IGXUYZQBNKNPRU-UHFFFAOYSA-N 270.723 3.290 70 20 CGID O=C(/C=C\c1ccccc1F)NCC1(O)CCCCCC1 217781340 IFLGDSWFBSORFA-KTKRTIGZSA-N 291.366 3.040 70 20 CGID C[C@H]1CCC[C@H](C)C1NC(=O)Nc1ccc2c(c1)OCO2 217235120 PEFBREKDOADQIZ-QWRGUYRKSA-N 290.363 3.362 70 20 CGID CCCOc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1 217632679 ILXQLUVIZJKCJZ-ROUUACIJSA-N 288.435 3.192 70 20 CGID CCN1CCCC[C@H]1CN[C@@H](C)c1ccccc1OC 161175314 DZCYQBASBWAJEX-GJZGRUSLSA-N 276.424 3.220 70 20 CGID CCC[C@@H]1CCCN(Cc2nnc(C)n2CCC)C1 161222665 GVHPTRHNZVHFFQ-CQSZACIVSA-N 264.417 3.009 70 20 CGID CCC[C@@H](CC)NC(=O)N1CCC(CCCN(C)C)CC1 161252359 CHAJRUWVQRVWIL-MRXNPFEDSA-N 297.487 3.329 70 20 CGID CCC[C@H](C)NC(=O)[C@H](C)SCc1c(CC)noc1C 160041063 BFJPXAQTQNELQV-JQWIXIFHSA-N 298.452 3.472 70 20 CGID CN(C[C@@H]1CCCOC1)C(=O)C1CCC(C)(C)CC1 160136380 VXIVRPBOOHFSIO-ZDUSSCGKSA-N 267.413 3.088 70 20 CGID Cc1ccc(-c2nnc(NC(=O)CC3CCCCC3)[nH]2)o1 160311639 LTFSPHURXLCHJR-UHFFFAOYSA-N 288.351 3.282 70 20 CGID CC1(C)C[C@H](Nc2nc3ccccc3cc2CO)CCO1 160583677 QAUDMGDAQNSVEM-CQSZACIVSA-N 286.375 3.097 70 20 CGID O=C(NCc1cccc2ccccc12)[C@@H]1CCCCO1 160984226 CJJVFNUZDJNPAD-INIZCTEOSA-N 269.344 3.025 70 20 CGID C[C@H](NC(=O)[C@H]1CCC[C@H](N)C1)c1ccc(F)cc1Cl 159626812 JGFRENDNLQTPKK-NHCYSSNCSA-N 298.789 3.174 70 20 CGID CC(C)n1cccc1C(=O)N[C@@H](C)Cc1ccc(O)cc1 159831182 VHYMPQRTBDMRGM-ZDUSSCGKSA-N 286.375 3.136 70 20 CGID CCOC(=O)Nc1ccc(NC(=O)C[C@@H](C)SC)cc1 159517355 BYGFWWWEXWIASB-SNVBAGLBSA-N 296.392 3.335 70 20 CGID O=S(=O)(Cl)CCCCSc1ccccc1 100495447 UIYIKMFSRZUDRL-UHFFFAOYSA-N 264.799 3.128 70 20 CGID CS[C@@H](C)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1 161338390 GWOKMUVICQSLNY-QWRGUYRKSA-N 299.823 3.071 70 20 CGID CC1(NC(=O)NCC2(c3cccc(F)c3)CC2)CCC1 161447237 VXBFINFJESBJOV-UHFFFAOYSA-N 276.355 3.099 70 20 CGID COCC(C)(C)C(=O)Nc1ccc(N2CCCC2)c(C)c1 161470334 IIHDLUIAXKFSMK-UHFFFAOYSA-N 290.407 3.206 70 20 CGID CS[C@@H](C)CC(=O)N(C)[C@@H](C)c1cccs1 160017383 XAXKDIQNJAUUQZ-UWVGGRQHSA-N 257.424 3.409 70 20 CGID C[C@H]1CCN(C(=O)Nc2ccc(N(C)C)nc2)C[C@H](C)C1 160083629 CZOARFVNCLZDTR-QWHCGFSZSA-N 290.411 3.048 70 20 CGID CC[C@H](NC(=O)[C@@H]1CC=CCC1)c1c(C)noc1C 160104272 LULORQCPYARZHJ-OLZOCXBDSA-N 262.353 3.215 70 20 CGID O=C(NCC1(C2CC2)CC1)c1csc(-c2ccoc2)n1 160108437 MVVGBQCTRSHTAF-UHFFFAOYSA-N 288.372 3.323 70 20 CGID CCCCCN(C(=O)c1cnc2c(c1)ncn2C)C(C)C 160187904 KEJGMAGQOHXPRY-UHFFFAOYSA-N 288.395 3.009 70 20 CGID CSC[C@H](CCO)N[C@@H]1CC[C@H](C)c2ccccc21 160326174 JLNPAWSQCBBJRN-HEHGZKQESA-N 279.449 3.329 70 20 CGID Cc1cncc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160628677 FTQMPYXQANBCQA-HUUCEWRRSA-N 269.348 3.117 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccsc1 160882125 DJCDGMGOBJZHOZ-ZDUSSCGKSA-N 279.405 3.360 70 20 CGID CCCCn1nccc1NC(=O)C[C@@H](C)c1ccncc1 159914884 FFNSMHIKAMUISN-CYBMUJFWSA-N 286.379 3.211 70 20 CGID Cc1occc1C(=O)NCCOc1ccccc1Cl 159368552 RWQAWSKXQKPPKO-UHFFFAOYSA-N 279.723 3.050 70 20 CGID CCCc1noc(CCCC(=O)N[C@H]2CCC[C@@H]2CC)n1 159557164 MRTNTROEYAQGPO-STQMWFEESA-N 293.411 3.040 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(OC)cc1C 159588762 OMHPYQBLVNJJEY-DOMZBBRYSA-N 261.365 3.312 70 20 CGID C[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1ccccc1F 218434788 CFBCPQNNGJMMTR-XJKCOSOUSA-N 265.372 3.275 70 20 CGID CC1(C)CC(NCc2cc(F)cc(F)c2)CC(C)(C)N1 159617622 DHRXODLHGVKDEK-UHFFFAOYSA-N 282.378 3.364 70 20 CGID CCCn1nccc1CN[C@@H]1CCCc2occc21 159991299 BUWLAJVVIINWNJ-CQSZACIVSA-N 259.353 3.053 70 20 CGID COc1ccc(OC)c([C@H](O)CN(C)[C@@H](C)C(C)(C)C)c1 217014600 WVDMVQAPJOMWCQ-SWLSCSKDSA-N 295.423 3.104 70 20 CGID O=C(OC1CCCC1)c1cccc(OC[C@@H]2CCCO2)c1 218476715 FXSXJJCSPBDRSO-INIZCTEOSA-N 290.359 3.344 70 20 CGID CC[C@H](NCCCNC(=O)C(C)C)c1ccc(F)cc1 159982085 SNGWEZVIXUDTMB-HNNXBMFYSA-N 280.387 3.029 70 20 CGID Cc1cc(CCCC(=O)N[C@@H](CO)CC(C)C)c(C)s1 161265780 LCZZMRLZTKCGSS-OAHLLOKOSA-N 297.464 3.211 70 20 CGID CCOC(=O)CCCCN1CCC[C@H]1c1cccc(C)n1 160064465 MSACRAGSMSXECY-INIZCTEOSA-N 290.407 3.260 70 20 CGID CCO[C@@H]1C[C@H](NCC2(CO)CCCC2)C12CCCCC2 160100719 RFFKCYZCHQYASM-JKSUJKDBSA-N 295.467 3.257 70 20 CGID C/C=C(\C=C\C(=O)NC[C@@H](O)c1ccc(C)cc1)CC 160224119 OUZIZONMWIBIOV-UCMUAVSNSA-N 273.376 3.057 70 20 CGID Cc1ncc([C@@H](C)NCCCN2CCCC[C@@H]2C)c(C)n1 160264826 ANSBVCSTRQCFPI-UONOGXRCSA-N 290.455 3.009 70 20 CGID O=C(Nc1cn[nH]c1)c1ccccc1OC1CCCCC1 160402728 OSDCMARFYROOJB-UHFFFAOYSA-N 285.347 3.374 70 20 CGID O=C(CCC1CCCC1)Cn1ccc2occc2c1=O 160407627 UVPVNADXOXBBDK-UHFFFAOYSA-N 273.332 3.134 70 20 CGID CC(C)(C)c1nnc(N[C@@H]2CCO[C@H](C3CC3)C2)s1 160472749 NHNPGHWJQWFJBF-MNOVXSKESA-N 281.425 3.205 70 20 CGID O=C(NCC1(Cc2ccccc2)CC1)N1C[C@@H]2CCC[C@H]2C1 160750901 UNUSLEQHJLZZGZ-IRXDYDNUSA-N 298.430 3.451 70 20 CGID CC(C)c1ccc(CN(C)C(=O)[C@@H]2CCCCO2)cc1 160828871 PGVSCHRVUNKUHN-INIZCTEOSA-N 275.392 3.338 70 20 CGID CCC1(CNC(=O)c2ccnn2C(C)C)CCCC1 159406587 VBBXULFYVQPIFH-UHFFFAOYSA-N 263.385 3.164 70 20 CGID COc1ccc2c(c1)[C@H](N[C@H]1CCCSC1)CCCO2 159531392 VGDPNMCNYTXHBR-SWLSCSKDSA-N 293.432 3.394 70 20 CGID C[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CC[C@@H]1O 159365867 PDTYYWOBPKUNDF-WBMJQRKESA-N 284.359 3.074 70 20 CGID Cc1ccccc1CCC(=O)NCC1(C2CC2)CC1 159992767 BONKMLRBQRRRTH-UHFFFAOYSA-N 257.377 3.234 70 20 CGID CCCn1nccc1CNc1cc(F)c(F)c(F)c1 160138761 NVFXQXPRRNHCHB-UHFFFAOYSA-N 269.270 3.323 70 20 CGID CCCCCNC(=O)c1ccnn1C(CC)CC 161097491 MDBXBJYXOAGKLS-UHFFFAOYSA-N 251.374 3.164 70 20 CGID CCc1nn(C)c(CC)c1CNCc1cc2ccccc2[nH]1 161328782 ADKYKVQHSHCMHV-UHFFFAOYSA-N 296.418 3.316 70 20 CGID Cc1cc([C@@H](C)NC(=O)Cc2c(C)noc2Cl)c(C)o1 161420345 IWLCANJBPKEGJO-MRVPVSSYSA-N 296.754 3.266 70 20 CGID Cc1ccc(SCC(=O)NCC2(C3CC3)CC2)cc1 160236892 VXUWEIPHVSQQAE-UHFFFAOYSA-N 275.417 3.394 70 20 CGID Cc1nc2n(n1)C[C@@H](N[C@@H]1CC[C@H](C)c3ccccc31)CC2 160493747 RYFXMQOYVGYOPF-RVSPLBMKSA-N 296.418 3.130 70 20 CGID C[C@@H]1CCCN(C(=O)N[C@H](C)c2ccsc2)C1 160524828 SBXGHYSBUBAOQM-GHMZBOCLSA-N 252.383 3.251 70 20 CGID Cc1csc(CCCCN[C@H](C)C2CCN(C)CC2)n1 160719109 FOAVSFOTJHINAK-CQSZACIVSA-N 295.496 3.094 70 20 CGID C[C@H]1CCC[C@H](NC(=O)N2CCC3(CCC3)C2)C1 160915939 WKWSTBFXIVTVSS-STQMWFEESA-N 250.386 3.151 70 20 CGID CCCSCC(=O)N[C@H]1CCOC2(CCCCC2)C1 160965128 YNQGZPSKXSZYOF-ZDUSSCGKSA-N 285.453 3.128 70 20 CGID CCC(C)(CC)C(=O)Nc1cc2c(cc1C)OCO2 159607147 VQKWBMLJLRMBPI-UHFFFAOYSA-N 263.337 3.489 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)N(C)Cc1cccnc1 159467333 KNTSDPNKVZJACE-ZIAGYGMSSA-N 286.400 3.214 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCc1nc2ccccc2s1 159678227 OOBPTTPRNIFGKX-MEBBXXQBSA-N 274.389 3.349 70 20 CGID Cc1cc(C)cc(-c2cc(NC(=O)[C@@H]3CC[C@@H](C)O3)[nH]n2)c1 159696727 SOHUMAZBMLTTCB-DOMZBBRYSA-N 299.374 3.200 70 20 CGID COC[C@H](NC(=O)Nc1ccc(CSC)cc1)C1CC1 159938904 QFAAPQOQQXQONA-AWEZNQCLSA-N 294.420 3.096 70 20 CGID CC[C@@H](C(=O)NC[C@H]1CCCCO1)c1ccc(F)cc1 159371044 CYYCMNNNIGSFMH-HUUCEWRRSA-N 279.355 3.005 70 20 CGID CCCOc1cccc(CNCCN(C)[C@H](C)CC)c1 217397318 GLIWPXVZIIVNGD-OAHLLOKOSA-N 278.440 3.295 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc(F)cc1F 217658814 MNDHLVASQINRJO-UVBJJODRSA-N 280.362 3.242 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1ccc(OC)cc1F 160066687 ZOKMGTOWKQLAEN-OLZOCXBDSA-N 282.403 3.215 70 20 CGID Cc1cc(F)ccc1OCC(=O)Nc1cccc(F)c1 160717300 GRIGWPTTXIYJKT-UHFFFAOYSA-N 277.270 3.291 70 20 CGID CCCCNC(=O)CSCc1ccc(CC)cc1 217229375 LCRGOEDBRQUYAU-UHFFFAOYSA-N 265.422 3.399 70 20 CGID CN(CC1=CCCOC1)Cc1cccc(Cl)c1 161133859 GTFMFALJPGSWMR-UHFFFAOYSA-N 251.757 3.119 70 20 CGID COc1ccc(C(C)(C)C(=O)N(C)CC(C)(C)C)cc1 161093061 GSGDIDGTTAFUCY-UHFFFAOYSA-N 277.408 3.477 70 20 CGID CCC[C@H]1[C@H](C)CCCN1C(=O)NCC1(CCOC)CC1 161125607 LPJYTAJFIVJLIP-CABCVRRESA-N 296.455 3.413 70 20 CGID FCCCSCc1cnn(-c2ccccc2)c1 161183607 RGVJRUCFPAVCSI-UHFFFAOYSA-N 250.342 3.465 70 20 CGID Cc1ccc(C(=O)N[C@@H](C)CC(=O)c2ccc(F)cc2)o1 161213239 BKQJPUAJQVEDFC-JTQLQIEISA-N 289.306 3.118 70 20 CGID CCN(CC)CCC[C@@H](C)NC(=O)[C@H]1CCC[C@H](C)C1 161291533 NUIXYWMRUPWTHI-XHSDSOJGSA-N 282.472 3.439 70 20 CGID CC1=C(C(=O)Nc2cnc3ccccc3c2)CCCO1 161437754 WOFSXWGGVABSNG-UHFFFAOYSA-N 268.316 3.258 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@@H](C)C[C@@H]2CCCO2)c1 160010125 GDQFKXQXFRRANK-YDHLFZDLSA-N 293.407 3.312 70 20 CGID COc1ccc2c(c1)[C@@H](NCC1(CO)CCCC1)CCC2 160084799 OINYSOYWXPBXCZ-KRWDZBQOSA-N 289.419 3.215 70 20 CGID CC(C)[C@@H](NC(=O)N[C@H](C)CCO)c1ccccc1Cl 160091175 GVYGXJPZFDAFIF-BXUZGUMPSA-N 298.814 3.107 70 20 CGID C[C@@H]1CC[C@H](CC(=O)N(C)c2ccc3c(c2)OCO3)C1 160226620 UCWUWTYAQRLJRH-NEPJUHHUSA-N 275.348 3.204 70 20 CGID C[C@H](NC(=O)Nc1ccc(-n2cccn2)cc1)C1CCC1 160302717 HDVVDBZXOWYWHG-LBPRGKRZSA-N 284.363 3.182 70 20 CGID CC(C)C1CCN(C(=O)C[C@@H](C)c2ccncc2)CC1 160729299 QKDCXFQAICALHA-CQSZACIVSA-N 274.408 3.470 70 20 CGID CCn1cc([C@@H](C)N[C@@H](CCCO)c2ccccc2)cn1 160812707 JMHOHANQQXIYOV-PBHICJAKSA-N 287.407 3.067 70 20 CGID Cc1nccn1-c1ncccc1NC(=O)[C@@H]1CCC[C@H](C)C1 160982201 FJYTXAINGKFMNF-GXTWGEPZSA-N 298.390 3.341 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cnc(-c2ccccc2)nc1 159555598 QUDQSTIYNMWTBP-XJKSGUPXSA-N 295.386 3.452 70 20 CGID CCCCCN(CCCS(=O)(=O)C(C)C)C(C)C 160789994 QXHMSSITPQREGZ-UHFFFAOYSA-N 277.474 3.100 70 20 CGID C[C@@H](C1CC1)N(C)C[C@@H](O)c1cc2ccccc2o1 216925637 VHUKXFVPOXOOQG-SMDDNHRTSA-N 259.349 3.197 70 20 CGID CC[C@@H]1CCCC[C@@H]1NC[C@H](O)Cc1ccccc1 161422584 FKYCYLXXFQTKTI-ZACQAIPSSA-N 261.409 3.148 70 20 CGID CN(CC1CCOCC1)C(=O)Nc1ccc2[nH]ccc2c1 160170192 QMLCHCRDWXJYPW-UHFFFAOYSA-N 287.363 3.058 70 20 CGID Cc1ccc(-c2nnc(NC(=O)CCC(C)(C)C)[nH]2)o1 160208938 PFZDWULIGUZVBI-UHFFFAOYSA-N 276.340 3.138 70 20 CGID Cc1nc2ccccn2c1CN1CCOc2cc(F)ccc21 160501012 IUZVXKDTFFKFCE-UHFFFAOYSA-N 297.333 3.181 70 20 CGID Clc1cncc(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160662430 PRMKPLNLGCXBPA-QWHCGFSZSA-N 289.766 3.462 70 20 CGID Cc1cc2cc([C@H](C)NCC(=O)NC(C)C)oc2cc1C 160923672 ADPTWPNCMDMXAS-ZDUSSCGKSA-N 288.391 3.225 70 20 CGID C[C@@H]1CCCN(C(=O)c2cc(F)c(Cl)cc2F)C1 160964751 UOQVRBJMKRCJPF-MRVPVSSYSA-N 273.710 3.490 70 20 CGID CCOc1ccccc1N(C)Cc1ccoc1C(=O)OC 159416315 UPZXAKFYZBKOOP-UHFFFAOYSA-N 289.331 3.101 70 20 CGID Cc1cncc(NC(=O)C(=O)Nc2ccc(C(C)C)cc2)c1 159860140 IWIDEOODPMNZGG-UHFFFAOYSA-N 297.358 3.091 70 20 CGID CCOCCC1(CNC(=O)c2c(F)cccc2F)CCC1 159525447 SFXDJPIFQNQNHZ-UHFFFAOYSA-N 297.345 3.292 70 20 CGID CCOCCC1(CNC(=O)c2cscc2C)CCC1 159551061 ZQSIKYOVWQQCQF-UHFFFAOYSA-N 281.421 3.383 70 20 CGID Cc1ccc(Br)c(C(=O)NCC2(C)CC2)c1 217856350 PNOZMBZHXHNDLJ-UHFFFAOYSA-N 282.181 3.287 70 20 CGID Clc1cccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159656814 WWHCFFNCVUZBQT-ZNMIVQPWSA-N 277.795 3.387 70 20 CGID CCCN(C)C(=O)c1cc(F)cc(C(F)(F)F)c1 218715435 QMMSPNLWEOZZDB-UHFFFAOYSA-N 263.234 3.327 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2cnc(C)s2)n1 160078682 XIUQKYXLPWNBLB-HNNXBMFYSA-N 273.405 3.492 70 20 CGID CC[C@@H](C)[C@@H](C)NC(=O)c1ccc(N(C)C)cc1F 161056035 MFBFRNYHULDZER-GHMZBOCLSA-N 266.360 3.056 70 20 CGID CCN(C(=O)Nc1cc(C(=O)OC)cs1)C1CCCC1 161092291 QZXFLCJPKMSFBO-UHFFFAOYSA-N 296.392 3.331 70 20 CGID CCCCN(C(=O)[C@H]1CCCNC1)[C@H](C)c1ccccc1 161356413 OBMJBXNLNYGPIX-WBVHZDCISA-N 288.435 3.376 70 20 CGID CC(C)CCNC(=O)c1cc(F)c(Cl)cc1F 161387783 KRUPJXXFMKNHHR-UHFFFAOYSA-N 261.699 3.394 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1ncnc2cc(F)c(F)cc12 161435322 KYOROUGXUMOCNC-VIFPVBQESA-N 295.333 3.117 70 20 CGID CCO[C@H](CC)C(=O)N(C)c1ccc(OC)c(Cl)c1 160069846 XJFRCJPMWACVSX-GFCCVEGCSA-N 285.771 3.127 70 20 CGID COc1ccc(N(C)C(=O)[C@@H](C)CSC)cc1Cl 160139675 UPHAQKWMJUKMKZ-VIFPVBQESA-N 287.812 3.311 70 20 CGID O=C(NCCSc1ccc(Cl)cc1)[C@H]1CCCCO1 160166795 UZRPIDUQEBIESB-CYBMUJFWSA-N 299.823 3.117 70 20 CGID Cc1cccc(C(=O)NCc2nc(C(C)C)cs2)c1O 160575513 DMQMCCCPIVJKAP-UHFFFAOYSA-N 290.388 3.211 70 20 CGID CC[C@H](NC[C@@H]1CCCO1)c1ccc(F)cc1F 160652047 XRUSSEDDCHQNIE-FZMZJTMJSA-N 255.308 3.185 70 20 CGID CC[C@H](C)C(=O)NCCc1csc(C(C)(C)C)n1 160711662 AMPWLAVNXYAIQE-JTQLQIEISA-N 268.426 3.145 70 20 CGID CN1CC[C@H](Nc2cc(Cl)cc(C(F)(F)F)c2)C1=O 159763211 JVCFXYVHKCUVJA-JTQLQIEISA-N 292.688 3.001 70 20 CGID CC(C)Oc1ccccc1CNCC1(CO)CCCC1 160117096 WAHUNHLZFIWICQ-UHFFFAOYSA-N 277.408 3.116 70 20 CGID CC(C)[C@H](CCO)NC(=O)c1csc2c1CC[C@@H](C)C2 161288524 RUSVINJIXFXANG-RISCZKNCSA-N 295.448 3.010 70 20 CGID Cc1ccccc1CCNC(=O)Nc1cc(Cl)ccn1 217315754 FFBQSCJSRGUGBT-UHFFFAOYSA-N 289.766 3.408 70 20 CGID CO[C@@H]1CCCC[C@H]1N[C@@H](C)c1ccc2c(c1)OCCO2 218183842 AVCJGYKELSGNES-NWANDNLSSA-N 291.391 3.066 70 20 CGID CC(C)c1cc(C(=O)NC2[C@@H](C)CCC[C@@H]2C)n[nH]1 217234736 HIRHWRNKIXFBBM-QWRGUYRKSA-N 263.385 3.088 70 20 CGID C[C@H]1CCCC[C@@H]1N(C)C(=O)CN(C1CCCC1)C1CC1 216859600 LVXQLQLYPLWLCS-YOEHRIQHSA-N 292.467 3.431 70 20 CGID C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN(C1CCCC1)C1CC1 216859579 LVXQLQLYPLWLCS-PBHICJAKSA-N 292.467 3.431 70 20 CGID CC1(C)CCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)F)c1 809282294 BTHSRCZVVYDRMO-GFCCVEGCSA-N 299.367 3.110 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 161014791 LWIMUMAJCGDKNN-DZGCQCFKSA-N 292.354 3.213 70 20 CGID CCCN(CCO)Cc1ccc(-c2ccccc2)o1 161193058 OSAPIPLUQFYLTB-UHFFFAOYSA-N 259.349 3.151 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CC1CCOCC1 161238003 SDKIZCSVZNDIJO-CABCVRRESA-N 267.413 3.230 70 20 CGID Cc1cccn2cc(CN[C@@H](C)CCc3ccco3)nc12 161461583 YVTBPJAKLZQQIC-AWEZNQCLSA-N 283.375 3.347 70 20 CGID CCN1C(=O)c2cc(Cl)ccc2N[C@H]1c1ccn(C)c1 160288629 IDRUROICCHMSKA-CQSZACIVSA-N 289.766 3.265 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)c1ccc(OC(C)C)cc1 160323980 WAJUSBUXIMPIAP-DZGCQCFKSA-N 297.464 3.238 70 20 CGID CSC[C@H](CCO)N[C@H]1CC[C@@H](C)c2ccccc21 160325830 JLNPAWSQCBBJRN-WWGRRREGSA-N 279.449 3.329 70 20 CGID CC[C@H](NC(=O)c1ccc(SC)o1)c1c(C)noc1C 160658087 RWFRALPXTSMRIL-JTQLQIEISA-N 294.376 3.487 70 20 CGID CCS[C@H]1CC[C@@H](N(C)Cc2cnc3ccccn23)C1 160879810 WHRSHVDZHDFYOC-HIFRSBDPSA-N 289.448 3.440 70 20 CGID Cc1cc([C@@H](C)NC(=O)N2CCO[C@@H](C)[C@@H]2C)c(C)s1 159833726 XVHSSKSHPXOPJW-WOPDTQHZSA-N 296.436 3.245 70 20 CGID CC[C@H](C)CN(CC)C(=O)c1ccc(F)c(OC)c1 159663708 NYPQMBXGAMSLBC-NSHDSACASA-N 267.344 3.343 70 20 CGID CCS[C@H]1CCC[C@H]1Nc1ccc(C(=O)OC)c(C)n1 218056475 BNTCGQPVBBKYMS-OLZOCXBDSA-N 294.420 3.263 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1ccnc(Cl)c1 159823595 KXSBRGNUZUZZHW-ONGXEEELSA-N 252.745 3.044 70 20 CGID CC[C@H](C)[C@H](NCc1cc(Cl)ccc1F)C(=O)OC 160743724 WMLRIVADRFVZEB-ZANVPECISA-N 287.762 3.156 70 20 CGID Cc1cccc(CNC(=O)Nc2ccc(N(C)C)cc2)c1 217311522 KCPYBKNFYSTFOJ-UHFFFAOYSA-N 283.375 3.383 70 20 CGID CCCC[C@@H](CC)CNC(=O)NCc1ccccc1CO 161118981 QATJUJUFGNFYSI-CQSZACIVSA-N 292.423 3.195 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cccc2c1OCO2 161184877 GXHATAIXYWVWGU-OCCSQVGLSA-N 289.375 3.456 70 20 CGID CC(C)[C@H](C)CC(=O)N1CCO[C@@H](c2cccs2)C1 161466501 ZJXMVWZFYKAYOS-CHWSQXEVSA-N 281.421 3.330 70 20 CGID C[C@H](NC(=O)Nc1nnc(C(C)(C)C)s1)C1CCC1 161477019 JJWBTYQZNUELKX-QMMMGPOBSA-N 282.413 3.146 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)NCCCC1CCCCC1 160012010 KUPAZFWGBUELCK-CJNGLKHVSA-N 279.424 3.468 70 20 CGID CC[C@H]1C[C@@H](C(=O)N[C@@H]2CCCc3sccc32)CCO1 160012996 IAVVYPOCLGWQCA-SGMGOOAPSA-N 293.432 3.447 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)CC[C@H](C)OC 160167035 REMODIMZZPKLOI-STQMWFEESA-N 280.364 3.423 70 20 CGID Cc1cccc2ncnc(N[C@@H]3CCO[C@@H](C4CC4)C3)c12 160332116 JOLSJNJINRNRCE-UKRRQHHQSA-N 283.375 3.308 70 20 CGID Cc1nscc1C(=O)N[C@H]1CCCc2sccc21 160371446 BSZKAEPIPKQTPG-NSHDSACASA-N 278.402 3.320 70 20 CGID COCCC1(CNC(=O)N[C@H](C)CC2CC2)CCCC1 160409844 WRJZWWIACSOSPL-CYBMUJFWSA-N 282.428 3.071 70 20 CGID CN(Cc1ccc([S@](C)=O)cc1)Cc1cccs1 160612947 COTGCAWSMLVMFA-GOSISDBHSA-N 279.430 3.118 70 20 CGID CC[C@H](NC(=O)c1ccccc1F)c1c(C)noc1C 160623393 DUFUJENQPOMWRL-ZDUSSCGKSA-N 276.311 3.312 70 20 CGID COc1ccc(C[C@@H](C)C(=O)NC[C@@H]2CC=CCC2)cc1 160707878 BLIOLLROSIOSCJ-GDBMZVCRSA-N 287.403 3.346 70 20 CGID CC[C@@H]1CCCN(C(=O)[C@H]2CCC(=O)C[C@@H]2C)CC1 160798718 SLZLAIJIZIYBPJ-GUTXKFCHSA-N 265.397 3.030 70 20 CGID Cc1ccc(NC(=O)[C@@H](C)N)cc1OCC1CCCCC1 161379152 UOVKXZICMOYLKN-CYBMUJFWSA-N 290.407 3.240 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@H]1c1cccc(C)n1 161394988 XHGXSGIDGJDLEY-INIZCTEOSA-N 299.422 3.037 70 20 CGID CCN(C(=O)c1ccc(F)c(SC)c1)C(C)C 160177617 PNELFJFINRSHII-UHFFFAOYSA-N 255.358 3.418 70 20 CGID CCC[C@H](C)CC(=O)Nc1ccc(C(=O)NC)cc1Cl 160256531 XSWHEJYQXDIREG-JTQLQIEISA-N 296.798 3.464 70 20 CGID Cc1cccc2nc(CN[C@@H](C)C3CCCC3)cn12 160339670 MWOFTFBTOWHZSQ-ZDUSSCGKSA-N 257.381 3.311 70 20 CGID CC[C@H](C(=O)Nc1nc(C)ns1)c1ccc(F)cc1 160560585 PZRQUFUTSLUWQF-NSHDSACASA-N 279.340 3.118 70 20 CGID O=[S@@](Cc1nccs1)c1cccc(Cl)c1 160658450 YKPKIJVRSTUPPB-OAHLLOKOSA-N 257.767 3.104 70 20 CGID CC(C)C[C@H]1COCCN1c1nc(C(C)(C)C)ns1 159846300 CGVBEYMWOZNBOL-NSHDSACASA-N 283.441 3.087 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)Cc1cccnc1 159883959 GZNLVKVEZIPKSP-UHFFFAOYSA-N 277.412 3.439 70 20 CGID COc1cccc2sc(NC(=O)C3(C)CC3)nc12 159542760 OEIXZBHJHAAAPI-UHFFFAOYSA-N 262.334 3.044 70 20 CGID CC(C)N1CCC[C@H](CNC(=O)C2CCC(C)(C)CC2)C1 159550898 ZRBVJNHBLCXATQ-OAHLLOKOSA-N 294.483 3.439 70 20 CGID CCCCOCCCNC(=O)Nc1ccccc1C 217310796 FQZMCTCVTGRUAX-UHFFFAOYSA-N 264.369 3.323 70 20 CGID C[C@H](C(=O)OC(C)(C)C)N1CC[C@@H](c2ccccc2)C1 217727209 FTISYVBWNJAWQR-UKRRQHHQSA-N 275.392 3.206 70 20 CGID CC[C@@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OC 159517527 GDLOTIQARIQGBP-BXKDBHETSA-N 289.297 3.308 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1cccc(C(F)(F)F)n1 161425403 CSFOSOXQFLCAJG-VIFPVBQESA-N 276.302 3.309 70 20 CGID CC(C)C(=O)NCCCN[C@H](C)c1ccc(Cl)cc1 159974336 DKPOURPYFGFPOI-GFCCVEGCSA-N 282.815 3.153 70 20 CGID CCc1nn(C)c(Cl)c1C(=O)N1CC[C@H](C)C[C@@H](C)C1 160047371 OCKLLQRQNKEMTE-WDEREUQCSA-N 297.830 3.144 70 20 CGID CC[C@@H](N[C@@H](CCO)CSC)c1ccc(F)cc1F 160287887 KQWMXDZEFGJFAN-SMDDNHRTSA-N 289.391 3.120 70 20 CGID C[C@H](CC(=O)N(C)Cc1cccn1C)c1cccc(F)c1 160819525 NLJUXKOAQPADOZ-CYBMUJFWSA-N 288.366 3.316 70 20 CGID C[C@@H]1CCC[C@H](NC(=O)N2CCC3(CCC3)C2)C1 160915836 WKWSTBFXIVTVSS-OLZOCXBDSA-N 250.386 3.151 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@H](C)C1CCC1 159406207 JXVSRFASTARHTL-SNVBAGLBSA-N 250.317 3.444 70 20 CGID Cc1oc(C)c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c1C 159847335 XMTNUGHMAUVNID-CQSZACIVSA-N 291.391 3.426 70 20 CGID Cc1cc(N[C@H](C)c2c(F)cccc2F)nn1C 159668423 QWUNBYVHESGROX-SECBINFHSA-N 251.280 3.180 70 20 CGID c1cn(CCN2CCC[C@@H]2CC2CCCCC2)cn1 159784570 WJLZRXSJMPTMGB-MRXNPFEDSA-N 261.413 3.318 70 20 CGID C[C@H](C1CC1)N(Cc1ccccc1)Cc1ccnn1C 159681206 BZJJJVFNBAPWNY-CQSZACIVSA-N 269.392 3.221 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc2[nH]ccc2c1 159765186 WKNHDGSOMZHBQB-UHFFFAOYSA-N 254.333 3.088 70 20 CGID C[C@H]1Cc2ccccc2N1C(=O)NCC1CCCC1 217575584 HJVKCDVYLJJZGI-LBPRGKRZSA-N 258.365 3.337 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCN3CCCC[C@@H]23)cc1F 217666794 CVJPDNMNBFYHAI-RCBQFDQVSA-N 292.398 3.112 70 20 CGID CCn1cc([C@H](C)NC[C@@]2(N(C)C)CCC[C@@H](C)C2)cn1 217458639 FDUXBMPXODVXRO-HLLBOEOZSA-N 292.471 3.064 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2csc(C)n2)n1 159803460 XHNSMMIPBSVALC-HNNXBMFYSA-N 273.405 3.492 70 20 CGID Cc1ccc([C@](C)(F)CS(=O)(=O)Cl)cc1C 1537958931 ONXUPYXUHIKVQL-LLVKDONJSA-N 264.749 3.057 70 20 CGID COC(=O)c1ccc(CNc2ccc(F)c(OC)c2)cc1 160015862 XQYKCPGOCRJNRG-UHFFFAOYSA-N 289.306 3.233 70 20 CGID Cc1cnc(N[C@H]2CCO[C@H](c3ccccc3)C2)nc1 160574215 SSHTVSNLRTVQIH-GJZGRUSLSA-N 269.348 3.117 70 20 CGID CCCNC(=O)Nc1cc(CC2CC2)nn1-c1ccccc1 160990861 IQZVJLLLOKHTQJ-UHFFFAOYSA-N 298.390 3.356 70 20 CGID COc1ccc(-c2noc([C@H]3CCC(=O)C[C@@H]3C)n2)cc1 160996237 BCBCYKFSOVQDHL-HZMBPMFUSA-N 286.331 3.218 70 20 CGID CN(C(=O)C[C@@H]1CSCCS1)c1ccc(F)cc1 159652176 MSIZMNACNGQQMH-GFCCVEGCSA-N 285.409 3.027 70 20 CGID Cc1cc(N[C@@H](C)c2ncc(C(C)(C)C)o2)nn1C 159576570 LVOWQZYNLDZNPW-JTQLQIEISA-N 262.357 3.187 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H](CC)[C@@H]2CCOC2)C1(C)C 159795595 ASMXNKQKFVQFMK-FXUDXRNXSA-N 283.456 3.375 70 20 CGID CC[C@H](NCC1(CO)CCCC1)c1ccccc1OC 160072471 FDDKCEXCWAXVGS-HNNXBMFYSA-N 277.408 3.289 70 20 CGID CN(Cc1ccccc1)CC(C)(C)NCc1cccnc1 159403623 QTDWTBMKAKOONT-UHFFFAOYSA-N 283.419 3.082 70 20 CGID CCc1ccc(/C=C/C(=O)N2CC[C@H](OCC(C)C)C2)o1 161082488 KMTARRBZYGLJIP-WAVCKPEOSA-N 291.391 3.129 70 20 CGID CCc1nc([C@H](C)NC(=O)NC2(C)CCC2)cs1 161166749 MFCBCFYPPQMQAQ-VIFPVBQESA-N 267.398 3.008 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)N(C)C(C)C 160017578 MDZIBKMWODJLKA-NSHDSACASA-N 284.425 3.034 70 20 CGID CC1(C)CCC(C(=O)N(CC(F)F)C2CC2)CC1 160101311 BVFINABUYKVEDI-UHFFFAOYSA-N 259.340 3.459 70 20 CGID Cc1c(Br)cccc1CS[C@H](C)CO 160154950 NNNGSJQGTBMSMD-MRVPVSSYSA-N 275.211 3.372 70 20 CGID CCc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)cc1 160156267 HJZBJQGQWXHQEA-UHFFFAOYSA-N 283.327 3.254 70 20 CGID CCOC(=O)[C@H](Sc1nncc2ccccc12)C(C)C 160253212 OLQRUFYHCQGIKI-CYBMUJFWSA-N 290.388 3.310 70 20 CGID O=C(N[C@H]1CCSc2c(F)cccc21)[C@H]1CCCCO1 160308045 KPKVXIQJMMCRGL-QWHCGFSZSA-N 295.379 3.048 70 20 CGID CCC(CC)c1nnc(NC(=O)CO[C@@H](C)CC)s1 160355004 OWAHUZJNSXRGEA-VIFPVBQESA-N 285.413 3.195 70 20 CGID Cc1ccc(NC(=O)NC2CC=CC2)cc1OC(F)F 160707112 FMPOKZMUYORUMQ-UHFFFAOYSA-N 282.290 3.437 70 20 CGID CS[C@@H](C)CC(=O)N[C@H](C)COc1cccc(C)c1 160847186 OHVOQWUHFDXLPS-OLZOCXBDSA-N 281.421 3.020 70 20 CGID Cc1nc2ccccn2c1CN1CCC(C(F)(F)F)CC1 160864727 YLFHKZIZTILLPI-UHFFFAOYSA-N 297.324 3.417 70 20 CGID Cc1nc2ccccn2c1CN1CCS[C@@H](C(C)C)C1 160878718 QMSXHZACWIOBED-OAHLLOKOSA-N 289.448 3.216 70 20 CGID C[C@H]1Cc2ccccc2N(C(=O)c2cccc3[nH]cnc23)C1 159417046 OMJMFAYJNWPPKM-LBPRGKRZSA-N 291.354 3.402 70 20 CGID CCC(C)(C)NC(=O)[C@@H](C)N[C@H](C)c1cccc(F)c1F 159533834 JVFHLQNGMMCJHH-GHMZBOCLSA-N 298.377 3.309 70 20 CGID O=C(N[C@@H](c1ccccc1)c1ccncc1)C1=CCCC1 159539951 LMFJTKJGHTWNBC-KRWDZBQOSA-N 278.355 3.398 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCCOCC(C)C 159961984 BKSGQHJPZGFFQC-KBPBESRZSA-N 295.448 3.339 70 20 CGID COC(=O)c1ccc(N[C@@H]2CCCC[C@H]2SC)nc1C 218033376 GRPHNMGZAFZUGQ-CHWSQXEVSA-N 294.420 3.263 70 20 CGID CC(C)[C@@H]1CCN(C(=O)C[C@@H]2CNc3ccccc32)C1 159592926 NVGDTYKSYIJOFD-ZIAGYGMSSA-N 272.392 3.090 70 20 CGID COc1cc(N[C@@H]2CCCc3c2cnn3C)ccc1F 159958397 SYLDYTPLJAKSCE-CYBMUJFWSA-N 275.327 3.057 70 20 CGID Cc1cccc(C(=O)N[C@@H](C)C(=O)OC(C)(C)C)c1Cl 160408975 NAQCWILZFDDJNP-JTQLQIEISA-N 297.782 3.108 70 20 CGID c1ccc2c(c1)NC[C@@H]2c1nc([C@H]2CCCS2)no1 160588302 ZYQZRJIKILCQGS-CMPLNLGQSA-N 273.361 3.195 70 20 CGID CCCO[C@H]1CCCN(CCCN2CCCCC2)CC1 161026358 GGUDAFMBVBCIMV-KRWDZBQOSA-N 282.472 3.144 70 20 CGID CCC1(CNC(=O)N[C@H](C)CSC)CCCC1 161073998 DDGWJEWUWQEKAM-LLVKDONJSA-N 258.431 3.008 70 20 CGID Cc1c(NC(=O)N2CC[C@@H](C)[C@@H]2C)cnn1CCC(C)C 161315544 QTSRJMGNLIRLDQ-OLZOCXBDSA-N 292.427 3.500 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@H]2c2ccccc2)cn1 161316913 FVFKIDSEMCZHNQ-CVEARBPZSA-N 297.358 3.042 70 20 CGID CCN(CC)C(=O)c1ccc(OCc2nccs2)cc1 161371433 UPGXIDOHIUECLK-UHFFFAOYSA-N 290.388 3.204 70 20 CGID COCCCNC(=O)[C@H](C)SCc1c(C)cccc1C 161380947 RFEVOPFUTXKBSP-AWEZNQCLSA-N 295.448 3.078 70 20 CGID CC(C)(C)c1cnc(Cn2nc(C3CC3)nc2C2CC2)o1 161420198 OIWQBSHDQKVKBV-UHFFFAOYSA-N 286.379 3.367 70 20 CGID Cc1ccoc1CNc1cccc(C(=O)N2CCCC2)c1 160062497 CWNGXXYNLCPOAZ-UHFFFAOYSA-N 284.359 3.436 70 20 CGID CS[C@H](C)CC(=O)N1CCCc2cc(F)ccc21 160151245 YRLCEKWOZOFFNN-SNVBAGLBSA-N 267.369 3.247 70 20 CGID C[C@H](CC(=O)N[C@@H]1CCCSC1)c1ccc(F)cc1F 160828938 ABTXYFURVHBOSE-ZYHUDNBSSA-N 299.386 3.470 70 20 CGID C[C@H]1CC[C@H](CCC(=O)N2CCc3c(F)cccc3C2)O1 160977196 QURJGRFMHMBNME-GXTWGEPZSA-N 291.366 3.058 70 20 CGID CCCCN1CCC(NC(=O)CCC(C)(C)C)CC1 159625828 TWQGMBRGDCYJPT-UHFFFAOYSA-N 268.445 3.193 70 20 CGID CC(C)CNC(=O)c1cc(C(C)C)n(-c2ccccc2)n1 159494676 RMOVVDZKZSZBRI-UHFFFAOYSA-N 285.391 3.382 70 20 CGID CN(Cc1cnn(C)c1)CC12CC3CC(CC(C3)C1)C2 218757663 UEYVGNJTDHVMKX-UHFFFAOYSA-N 273.424 3.068 70 20 CGID CCc1ncnc(NC[C@@]2(N(C)C)CCC[C@@H](C)C2)c1F 217985687 BZGIEPJTRBWKCC-MLGOLLRUSA-N 294.418 3.101 70 20 CGID Cc1ccc(F)c(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1 161059076 ZPZBBNCQULBWTA-WFASDCNBSA-N 292.354 3.213 70 20 CGID COC[C@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)C1CC1 161251230 MJLIPRGKVMVBMQ-NHYWBVRUSA-N 295.810 3.060 70 20 CGID C[C@H]1CN(C)CC[C@@H]1NCCSc1ccc(Cl)cc1 160063696 QRHOMXOSLJVRHY-WFASDCNBSA-N 298.883 3.362 70 20 CGID C[C@H](NC[C@@H](C1CCCCC1)N(C)C)c1cncs1 160399934 DFBNFTWJTUHQSE-JSGCOSHPSA-N 281.469 3.304 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](CC)C(C)C)c1 160616813 JLCOHJPJEAWPFY-INIZCTEOSA-N 276.424 3.351 70 20 CGID Cc1csc(N2CCN(c3ccc(Cl)cc3)CC2)n1 160648678 YSRMJLQJQVPJSO-UHFFFAOYSA-N 293.823 3.432 70 20 CGID CC(C)CCn1ccc(NC(=O)N(C)[C@@H](C)C2CC2)n1 160731827 IFCNCCRXKFWXHL-LBPRGKRZSA-N 278.400 3.191 70 20 CGID Cc1cccc([C@H](C)CNC(=O)CNc2ccccc2)c1 160734461 ORGVZJFEURDLLQ-OAHLLOKOSA-N 282.387 3.327 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccc(F)cc1 160754012 OBLUUUFMAXCBAN-OAHLLOKOSA-N 291.366 3.437 70 20 CGID CC(C)Oc1c(Cl)cccc1NC(=O)[C@@H]1CCCNC1 160922494 RUWXZMPQGIAGAV-LLVKDONJSA-N 296.798 3.065 70 20 CGID CC1(C)Cc2cccc(CN3CCCC[C@@H]3CCO)c2O1 159720151 MSTYRFMFDMFMLK-MRXNPFEDSA-N 289.419 3.137 70 20 CGID Cc1nccc(NC(=O)N(C)[C@H]2CCSC2)c1Cl 159541041 SLIDAUSAMHXEIU-VIFPVBQESA-N 285.800 3.013 70 20 CGID C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccccc1F 217679582 NBWGACAECLZZGL-RCBQFDQVSA-N 262.372 3.103 70 20 CGID C[C@@H](CNCc1coc2ccccc12)CN1CCCC1 159823234 JWVZLBAANINMLJ-AWEZNQCLSA-N 272.392 3.254 70 20 CGID CC(C)N1CC[C@@H](CNCc2ccc(Cl)cc2F)C1 160789342 HMPWKSGEPQQEEE-LBPRGKRZSA-N 284.806 3.299 70 20 CGID CC(C)C[C@H]1CCCN1CCCN1CCCCC1 160755699 JPBOISHRPIXFKU-MRXNPFEDSA-N 252.446 3.373 70 20 CGID Cc1ccc(OCC(=O)N2CCc3c(F)cccc3C2)cc1 161042236 ZCMJRHNLRZFXOQ-UHFFFAOYSA-N 299.345 3.098 70 20 CGID CC[C@H](C)C(=O)N(Cc1ccccc1)CC1(O)CCCC1 161239598 HPNUJBHKMADNMJ-HNNXBMFYSA-N 289.419 3.366 70 20 CGID CC[C@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccccc1 161414777 HZSPUWKXQZLRID-GOEBONIOSA-N 295.448 3.019 70 20 CGID CCCCCOCC(=O)N[C@H]1CCc2c(OC)cccc21 160133236 KCZQUXHIFQVXSZ-HNNXBMFYSA-N 291.391 3.006 70 20 CGID COc1ccc(N(C)C(=O)[C@H]2CCCS2)cc1Cl 160149804 WNSUQNIWNNPVHQ-GFCCVEGCSA-N 285.796 3.207 70 20 CGID CS[C@H](C)CNC(=O)N[C@H]1CCCCC1(C)C 160266215 WHQIYHBMJHOBFC-MNOVXSKESA-N 258.431 3.006 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)c1cncc(F)c1 160270072 MNQMKGLTKMZRHW-GFCCVEGCSA-N 276.336 3.090 70 20 CGID CC[C@H](N[C@H](C)CCOC)c1ccc(F)cc1F 160859568 XUXOTXSIMCCAKD-YGRLFVJLSA-N 257.324 3.431 70 20 CGID CC[C@H](C(=O)N(C)CCSC)c1ccc(F)cc1 160960634 VEKGFMPZOJDTGU-ZDUSSCGKSA-N 269.385 3.141 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CSc1nncs1 160901545 FJMRXNPYTCDFFV-MNOVXSKESA-N 299.465 3.057 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2c(C)nn(C)c2C)n1 159843309 OJNYJYYGZWTUBJ-QGZVFWFLSA-N 284.407 3.077 70 20 CGID c1cc(CN2CC[C@@H]3CCCC[C@@H]32)c2c(c1)OCCO2 159702526 DIAJWROWSLHHHO-ZFWWWQNUSA-N 273.376 3.222 70 20 CGID C[C@@H]1CC[C@H](C(=O)Nc2cc(C(C)(C)C)ccc2O)O1 159571427 JEUNTWXOUYELGN-QMTHXVAHSA-N 277.364 3.196 70 20 CGID C[C@H](CN1CCCCC1)NCc1cc(F)cc(Cl)c1 160887547 SSZVSMOFDOHXKW-GFCCVEGCSA-N 284.806 3.443 70 20 CGID COc1ccc(NC(=O)N2[C@H]3C=CC[C@H]2CC3)cc1 218754065 IVABSYAOBNDLLF-STQMWFEESA-N 258.321 3.020 70 20 CGID O=C(NCCCOc1ccccc1)NC1CCCCCC1 217299776 CMIXGIQQJGZALY-UHFFFAOYSA-N 290.407 3.478 70 20 CGID CCC(CC)C(=O)N[C@H](CC)c1c(C)noc1C 160419288 UIWSGTRKQTXLMM-GFCCVEGCSA-N 252.358 3.295 70 20 CGID C[C@@H](NC(=O)C(F)F)c1ccc2c(c1)CCCC2 218686223 IWVVYFIWUHKEFP-SECBINFHSA-N 253.292 3.008 70 20 CGID CC(C)(C)C1CCC(CS(=O)(=O)Cl)CC1 156938692 PAAXQEVGOQQLFQ-UHFFFAOYSA-N 252.807 3.408 70 20 CGID CCc1ncc(NC(=O)Nc2cc(C)cc(C)c2)cn1 161191443 QIRKVMSFHUAQEX-UHFFFAOYSA-N 270.336 3.300 70 20 CGID O=C(CCC1CCCC1)Cn1cnc(-c2ccccc2)n1 160420085 HYOBASAORYNIIT-UHFFFAOYSA-N 283.375 3.485 70 20 CGID CC[C@H](C)OCC(=O)Nc1cc(NC(C)=O)ccc1Cl 160466782 CAJVMVROZACOOM-VIFPVBQESA-N 298.770 3.052 70 20 CGID CCCN(Cc1ccccc1)Cc1nc(O)cc(CC)n1 160520368 GHPIIXCWPFKHGN-UHFFFAOYSA-N 285.391 3.157 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1ccccc1F 160591978 USKIXKOOOWWVEU-UHFFFAOYSA-N 289.354 3.313 70 20 CGID CCCCOc1cccc(CN[C@@H](C)[C@@H]2CCOC2)c1 160817651 RRMQXGJXUXDUFP-GOEBONIOSA-N 277.408 3.380 70 20 CGID C[C@@H](OC1CCCCCC1)C(=O)Nc1ccncc1 159604689 QNOXBRLDGCPHCM-GFCCVEGCSA-N 262.353 3.148 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(C)cc1F)[C@H]1CCCO1 159439840 JRKHHEJDHKZUOF-TZMCWYRMSA-N 280.343 3.213 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(F)cc2)cc1F 159464651 ACSVRPHHKIRACN-UHFFFAOYSA-N 277.270 3.250 70 20 CGID C[C@H]1C[C@H]1c1ccc(CN(CCn2ccnc2)C2CC2)o1 159695650 VKZMAZBHIJVYDV-XJKSGUPXSA-N 285.391 3.264 70 20 CGID COc1ccc(CN(C)C)cc1NCc1ccc(C)nc1 159569530 UBEROHQHHVQCPJ-UHFFFAOYSA-N 285.391 3.072 70 20 CGID COCc1nc(C)c(C(=O)NC[C@H]2CCCC[C@H]2C)s1 159985150 QRXHYTNQLBBIHP-ZYHUDNBSSA-N 296.436 3.154 70 20 CGID CC1(C)C[C@H](NCc2csc(C3CC3)n2)CCO1 160543318 NFCSGYDVVYAUAQ-LLVKDONJSA-N 266.410 3.068 70 20 CGID CCOc1ncccc1NC(=O)c1cccc(C)c1F 161453412 MREHVXFVPXWPTL-UHFFFAOYSA-N 274.295 3.180 70 20 CGID C1CCN(CCCN2CCS[C@H]3CCCC[C@@H]32)CC1 161493870 MODAYSVFLKEXHH-HOTGVXAUSA-N 282.497 3.222 70 20 CGID CCCCCC(=O)N[C@H]1CCC[C@@H]1NC(=O)CCCCC 217808809 XNHHKDWDOXHUNR-GJZGRUSLSA-N 296.455 3.301 70 20 CGID C[C@H](c1ccco1)N(C)CCCN1CCCCC1 161299517 WQHFHYROCGHYGM-CQSZACIVSA-N 250.386 3.148 70 20 CGID CC(C)(C)NC(=O)N(Cc1ccco1)Cc1ccco1 161057516 LUIPOCLJZWSTDT-UHFFFAOYSA-N 276.336 3.383 70 20 CGID CC1(NC(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)CCC1 161360572 VSGATXSEWCHORE-STQMWFEESA-N 282.428 3.070 70 20 CGID CC(C)OCCN[C@@H](c1ccc2c(c1)OCCO2)C(C)C 161478530 BORYXIDJVWDZLB-QGZVFWFLSA-N 293.407 3.170 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1 160132971 DCHQENAWTSJNPV-SJLPKXTDSA-N 288.435 3.013 70 20 CGID CC(C)OC(=O)CCCNc1nc(C(F)(F)F)cs1 160251509 CAKVJEKHVXEIIB-UHFFFAOYSA-N 296.314 3.306 70 20 CGID C[C@H]1[C@@H](C)Sc2ccccc2N1C(=O)[C@@H]1CCCO1 160263929 ALNNSSUZZWFVPD-LOWVWBTDSA-N 277.389 3.081 70 20 CGID O=C(C[C@H]1CCCCO1)N[C@@H]1CCCc2sccc21 160269548 XIYXGCFJXPTOFT-DGCLKSJQSA-N 279.405 3.201 70 20 CGID CCc1ccc(CC(=O)N2CCC[C@@H]2c2ccc[nH]2)cc1 160303275 UOBINEICEZKWQL-QGZVFWFLSA-N 282.387 3.483 70 20 CGID CC[C@@H](CN[C@@H]1CCN(C)[C@H](C)C1)Oc1ccccc1F 160304762 DBPAPNUZBTXZBM-KFWWJZLASA-N 294.414 3.055 70 20 CGID CC[C@@H](Cc1ccccc1)NC(=O)NC1(C)CCC1 160651232 CKRAATQKFFMNDG-AWEZNQCLSA-N 260.381 3.250 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)c1ccc(F)cn1 160304695 XDYIQHAJPNCQBM-LLVKDONJSA-N 276.336 3.090 70 20 CGID CCC(CC)NC(=O)N[C@H](C)c1ccc(OC)cc1 217304920 SLJLNKNWYRSGSD-LLVKDONJSA-N 264.369 3.244 70 20 CGID CCOc1ccc(CNC(=O)N2CCC(C)CC2)cc1 217300740 SWGCYTFWNBPXNY-UHFFFAOYSA-N 276.380 3.027 70 20 CGID C[C@@H](CNC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)N(C)C1CC1 216730068 RDJFICVOSDVNRJ-QLFBSQMISA-N 294.483 3.438 70 20 CGID CCc1ccc(CN(C(=O)[C@@H]2CCCCO2)C2CC2)cc1 161025647 XWVMMZDTHOOTDW-KRWDZBQOSA-N 287.403 3.309 70 20 CGID C[C@@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)C[C@@H]1C 161330958 KHANVLGMHHHDBR-CABCVRRESA-N 294.483 3.249 70 20 CGID Cc1ccccc1CN(C)Cc1c[nH]nc1-c1cccnc1 160526448 SGTKPBWPOODRFY-UHFFFAOYSA-N 292.386 3.412 70 20 CGID C[C@@H](CCC(=O)NC[C@H](C)C[C@@H](C)O)c1ccccc1 160685325 NQILZUHXTMPYLC-QLFBSQMISA-N 277.408 3.094 70 20 CGID CCCC1(CN[C@H](C(=O)OC)c2ccccc2F)CC1 160774531 YCVHBFFEYGBZER-AWEZNQCLSA-N 279.355 3.210 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(CCOC)Cc1ccccc1 159474699 IFRLTPHDHVIXBS-NVXWUHKLSA-N 275.392 3.098 70 20 CGID CCc1ccc([C@H](C)CC(=O)Nc2cccn(C)c2=O)cc1 159920903 SWIFREPYKIRWNZ-CYBMUJFWSA-N 298.386 3.080 70 20 CGID COc1cccc(Cl)c1CC(=O)N[C@H](C)CC1CC1 159958044 QBOZNSABUPAHJX-SNVBAGLBSA-N 281.783 3.196 70 20 CGID CC[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccccc1 217687809 AJIFWQUCXMDEPG-BBWFWOEESA-N 258.409 3.354 70 20 CGID CC1(O)CCN(C(=O)c2cc3c(s2)CCCCC3)CC1 161261554 CRCCARUJQGFDJX-UHFFFAOYSA-N 293.432 3.004 70 20 CGID CC[C@@H]1CCCN(C(C)(C)CN[C@@H](C)c2cnccn2)C1 161016752 MMEINDNUVSGJEY-LSDHHAIUSA-N 290.455 3.028 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 161125221 DRVOPGQVGQFJSC-UKRRQHHQSA-N 292.354 3.213 70 20 CGID CCCn1nccc1CNc1cccc(-c2ccn[nH]2)c1 160079952 AOQYPUZFUVVBQB-UHFFFAOYSA-N 281.363 3.295 70 20 CGID CCCC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 160155361 YVGNGOPLRVIIHG-KRWDZBQOSA-N 268.360 3.396 70 20 CGID C[C@@H]1CN(C(=O)Nc2cnc(C(C)(C)C)nc2)CC[C@H]1C 160382924 ICKBBNAONXQHOU-VXGBXAGGSA-N 290.411 3.284 70 20 CGID c1ccc(NCc2nc([C@@H]3CCCS3)no2)cc1 160621234 CEILWDFVUPEJCO-NSHDSACASA-N 261.350 3.250 70 20 CGID CCn1nccc1CN(C)Cc1ccc(OC(F)F)cc1 160624695 VMWPIRCVKRBSMT-UHFFFAOYSA-N 295.333 3.136 70 20 CGID COC[C@@H](NC(=O)Nc1cccc(C)c1Cl)C1CC1 160717824 HTPAUMPPUBFNOF-GFCCVEGCSA-N 282.771 3.195 70 20 CGID CCn1nc(C)c(NC(=O)C[C@H](C)c2ccncc2)c1C 160739362 NCZDDUMSUWLECN-NSHDSACASA-N 286.379 3.047 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 160993134 AICQEIXORIHQAR-XNJJOIOASA-N 288.391 3.258 70 20 CGID CC[C@H](C)OCC(=O)Nc1c(F)cccc1NC1CC1 159624091 HFPOBDNKXRVWBB-JTQLQIEISA-N 280.343 3.154 70 20 CGID CO[C@H](C)CC(=O)N1C[C@@H](C)CSc2ccccc21 159633694 JLNXWZQEBNQATE-VXGBXAGGSA-N 279.405 3.186 70 20 CGID CC(C)[C@H](Cc1ccccc1)C(=O)N1CCOC(C)(C)C1 159746769 XMMKROYYOKBUNM-INIZCTEOSA-N 289.419 3.139 70 20 CGID CCSCCN(Cc1ccco1)C[C@@H]1CCCO1 159584470 HVBNTVMYQCCIIW-AWEZNQCLSA-N 269.410 3.014 70 20 CGID CC[C@H](O)CCNC(=O)[C@H](c1ccccc1)[C@H](C)CC 218095115 LALIVICMCSUGSA-KBMXLJTQSA-N 277.408 3.094 70 20 CGID CCCC1(CNCc2ccccc2NC(C)=O)CC1 160563435 DBUJTEYXYOVJIX-UHFFFAOYSA-N 260.381 3.315 70 20 CGID C[C@@H](CN1CCCCC1)NCc1cc(F)cc(Cl)c1 160887399 SSZVSMOFDOHXKW-LBPRGKRZSA-N 284.806 3.443 70 20 CGID CCC(C)(CC)C(=O)NC[C@@H](C)c1nccs1 159482506 UHHVHRQPMBDHOC-SNVBAGLBSA-N 254.399 3.189 70 20 CGID CC[C@H](C)CCC(=O)Nc1ccc(S(=O)(=O)F)cc1 808730651 JFRVVKGYISLJPZ-JTQLQIEISA-N 287.356 3.110 70 20 CGID CCCN(CCO)Cc1cnc(C2CCCC2)s1 161205082 LZACTOGXFMJBAG-UHFFFAOYSA-N 268.426 3.005 70 20 CGID CS[C@H](C)CC(=O)N1CCC[C@@H]1C1CCCC1 160708786 KVNFTQQEKFCGSY-DGCLKSJQSA-N 255.427 3.309 70 20 CGID CCc1ncsc1NC(=O)C[C@H](C)c1c(C)noc1C 161028881 QKLADKYSRTZYFM-QMMMGPOBSA-N 293.392 3.443 70 20 CGID COc1ccc(Cl)c(NC(=O)[C@@H]2CC2(C)C)c1 161354397 YMSLJPLYNGKGGS-VIFPVBQESA-N 253.729 3.333 70 20 CGID C[C@@H]1CCC[C@H](C(=O)N(Cc2ccncc2)C2CC2)C1 161473775 GCJAKUALEDARLH-HIFRSBDPSA-N 272.392 3.399 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(-n2ccnc2)c(F)c1 160565401 NXXGMCNTSYODOA-SNVBAGLBSA-N 293.367 3.092 70 20 CGID CCN(Cc1ccoc1)C(=O)c1cncc(OC(C)C)c1 160642064 QRHYLCDLMWCVPX-UHFFFAOYSA-N 288.347 3.124 70 20 CGID CCCCCc1nnc(NC(=O)C[C@@H](C)SC)s1 160752952 MYLBAGOOPJQEPY-SECBINFHSA-N 287.454 3.351 70 20 CGID COC(=O)c1csc(NC(=O)N2C[C@@H](C)C[C@@H](C)C2)c1 160772291 CTQGLGXBFRIZSH-AOOOYVTPSA-N 296.392 3.045 70 20 CGID Cc1n[nH]c(C)c1NC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F 160793357 OUFPVACKSICMCU-MNOVXSKESA-N 291.301 3.047 70 20 CGID COc1ccc(C)cc1NC(=O)N[C@H]1CCOC(C)(C)C1 160847807 CVXVEVWSVYVVOK-LBPRGKRZSA-N 292.379 3.083 70 20 CGID COc1cccc([C@@H](CNc2ccnc(C)c2)N(C)C)c1 160915223 WYESYOKWXRXBRH-QGZVFWFLSA-N 285.391 3.113 70 20 CGID O=C(NCc1ccc(O)c(F)c1)c1cccc(Cl)c1F 159804125 AMOSLNGAAYZTLJ-UHFFFAOYSA-N 297.688 3.254 70 20 CGID CSc1cc(C(=O)N(C)Cc2ccccn2)ccc1F 159444500 LCAKWTKAOSNJTI-UHFFFAOYSA-N 290.363 3.215 70 20 CGID Cc1nccc(NC(=O)N2CC[C@H](C)[C@H]2C)c1Cl 159647779 JWBPCPWZSRNYPK-WCBMZHEXSA-N 267.760 3.306 70 20 CGID Cc1ccc([C@@H](C)NC(=O)Cc2c(C)noc2Cl)cc1 159844113 MJVBJWMUSXZZSH-SNVBAGLBSA-N 292.766 3.365 70 20 CGID CCOc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159475626 SOWKZUNPBFZLQG-ZACQAIPSSA-N 287.403 3.133 70 20 CGID CC[C@H](N[C@@H](C)c1cccc(OC(C)C)c1)C(=O)OC 159503936 FZYYFGYYBAVXAR-WFASDCNBSA-N 279.380 3.076 70 20 CGID C/C(=C/c1ccccc1)CNCCN1CCC[C@H](C)C1 216986789 NQAXULMPMZHTCQ-MUBYSKIDSA-N 272.436 3.411 70 20 CGID COc1ccc(C(=O)N(C)Cc2ccccc2F)c(F)c1 218437129 XANMLZQOMAUYQN-UHFFFAOYSA-N 291.297 3.246 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@H]2CCCC[C@H]2OC)c1 218189650 LCQOKWZYZBZUCG-YLQAJVPDSA-N 293.407 3.312 70 20 CGID CC(C)OC(=O)c1ccn(CCCc2ccccc2)c(=O)c1 161033178 NZUZCDGSDSYAEG-UHFFFAOYSA-N 299.370 3.046 70 20 CGID CCCCn1ncc(C(=O)N[C@H]2CCC[C@H](C)C2)c1C 161053818 LVGSNYCWXDRBBV-JSGCOSHPSA-N 277.412 3.300 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)C[C@@H]1CCCCO1 161139477 TVCDCIVUJOSTSL-QLFBSQMISA-N 267.413 3.373 70 20 CGID CCNc1nc(SCc2ccnn2C)nc2ccccc12 161301413 HLOGQKGZHFCOMX-UHFFFAOYSA-N 299.403 3.087 70 20 CGID Cn1cnnc1CNC(C)(C)c1ccc(Cl)c(Cl)c1 161453187 LQHDLROTEWHERB-UHFFFAOYSA-N 299.205 3.147 70 20 CGID Cc1cc(NC(=O)CCN2CCCC[C@H]2CC(C)C)no1 160331213 GWNSUPBOMWGPGV-AWEZNQCLSA-N 293.411 3.212 70 20 CGID C[C@@H]1CCN(C(=O)CCc2ccc(F)cc2F)[C@@H]1C 160711152 NTRRHBSJMKJRML-GHMZBOCLSA-N 267.319 3.154 70 20 CGID CCCC1(CNC(=O)c2ccccc2-n2cccn2)CC1 160755440 SPQTVXVWRLYSIW-UHFFFAOYSA-N 283.375 3.182 70 20 CGID COc1ccc(-c2noc([C@@H]3CCC(=O)C[C@@H]3C)n2)cc1 160996475 BCBCYKFSOVQDHL-IINYFYTJSA-N 286.331 3.218 70 20 CGID CCC(C)(CC)C(=O)NC[C@@H](C)c1nc(C)cs1 159479407 ZPZYORXPSRVTED-SNVBAGLBSA-N 268.426 3.498 70 20 CGID CCC(C)(C)NC(=O)[C@@H](C)N[C@@H](C)c1cccc(F)c1F 159533553 JVFHLQNGMMCJHH-WDEREUQCSA-N 298.377 3.309 70 20 CGID Cc1ccc(F)cc1NC(=O)N(C)CCc1nccs1 159931745 YXSQTOACMRNBSA-UHFFFAOYSA-N 293.367 3.297 70 20 CGID CC1CCC(O)(CN(CCc2nccs2)C(C)C)CC1 159780598 UXEWBMLGEKNVTL-UHFFFAOYSA-N 296.480 3.337 70 20 CGID C[C@H](CN[C@@H]1CCN2CCCC[C@@H]12)c1ccccc1 217630859 CCULJWMTQSQBTH-OIISXLGYSA-N 258.409 3.007 70 20 CGID Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1C 159659193 KFJBNYODJVJEHF-ZACQAIPSSA-N 271.404 3.351 70 20 CGID CNC[C@H](C)C(=O)N(C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 161454642 IXQVOHXRHZDMOZ-XQQFMLRXSA-N 296.842 3.146 70 20 CGID CCCn1nc(C)c(C(=O)NCc2ccccc2C)c1C 161459819 QPIDCYMMPLHQMU-UHFFFAOYSA-N 285.391 3.148 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1nccs1 160031475 PGKKCHWCWOBDOR-RKDXNWHRSA-N 264.375 3.255 70 20 CGID Cc1noc(C)c1C[S@@](=O)c1ncc(C(C)(C)C)s1 160602052 AJLYBZSCYLIDPW-IBGZPJMESA-N 298.433 3.353 70 20 CGID Cc1ccc([C@@H](NCc2nncn2C)c2ccccc2)cc1 160695680 KWKYDQSVHUSUHX-SFHVURJKSA-N 292.386 3.003 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 159804559 HRQMENLZFSXATB-PBHICJAKSA-N 286.375 3.188 70 20 CGID CCc1nc(NC(=O)C(C)(CC)CC)sc1C(=O)OC 159502021 KUHOMDAZQNJXPJ-UHFFFAOYSA-N 298.408 3.257 70 20 CGID C[C@H](NC[C@](C)(O)c1ccsc1)c1cccnc1Cl 159957696 YXWJXRMXHHIWQS-HZMBPMFUSA-N 296.823 3.355 70 20 CGID Fc1cc(Cl)ccc1CNCCCCn1ccnc1 160805551 AVOSETNKPMLSAE-UHFFFAOYSA-N 281.762 3.246 70 20 CGID CCC[C@H]1CN(CCC(=O)c2ccc(C)cc2)CCO1 161137889 UANORPJCWVXJML-INIZCTEOSA-N 275.392 3.069 70 20 CGID CCC(C)(C)C(=O)N[C@H]1CCc2c(OC)cccc21 160133526 NTWYYTRWUGRACL-ZDUSSCGKSA-N 261.365 3.235 70 20 CGID COCCOc1cccc(NC(=O)N[C@@H](C)CC(C)C)c1 161058890 UZPSYUHEZXLLEW-ZDUSSCGKSA-N 294.395 3.268 70 20 CGID COc1ccc(COCCCN[C@@H](C)C2(C)CC2)cc1 161095105 UEZCEODITOQQNK-AWEZNQCLSA-N 277.408 3.380 70 20 CGID CC[C@H](C(=O)N[C@@H](C)C1CCOCC1)c1ccc(F)cc1 161137684 HVBQNLYNZMSGBX-LRDDRELGSA-N 293.382 3.251 70 20 CGID C[C@@H](Nc1ccc2oc(N(C)C)nc2c1)c1ccncc1 160026870 ZILDEBVVYLRHMC-LLVKDONJSA-N 282.347 3.462 70 20 CGID CC(=O)c1c[nH]c(C(=O)N[C@H]2CCCc3sccc32)c1 160049303 IAXRLCOPBQZZSN-LBPRGKRZSA-N 288.372 3.086 70 20 CGID CC/C=C(/C)C(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 160166722 WGESNTOYUYHLOJ-PSIJOBTASA-N 275.392 3.014 70 20 CGID CC[C@@H](C)OCC(=O)N[C@H](C)c1c(F)cccc1Cl 160442010 XWNWBCBSIYOAGU-NXEZZACHSA-N 287.762 3.471 70 20 CGID CCn1cc([C@@H](C)NCCCCc2nc(C)cs2)cn1 160684133 MSVXCXNXAJTICH-CYBMUJFWSA-N 292.452 3.341 70 20 CGID CC1(NC(=O)NCc2nc(C(C)(C)C)cs2)CCC1 160845602 OQZOQNUACYXBJL-UHFFFAOYSA-N 281.425 3.182 70 20 CGID Cc1conc1NC(=O)[C@@H](C)Cc1ccccc1Cl 160949845 CKHRBCXJWGKJRS-VIFPVBQESA-N 278.739 3.454 70 20 CGID CCOc1ccc(NC(=O)[C@H]2C[C@]2(C)CC)cc1OC 159842345 RIAWYXCQTWXBIY-WBMJQRKESA-N 277.364 3.469 70 20 CGID COCC[C@@H](Cc1cccc(F)c1)N[C@H]1CCCSC1 159542852 MWWLRGRWPAGHQV-HOTGVXAUSA-N 297.439 3.259 70 20 CGID C[C@H]1Cc2ccccc2[C@@H]1NC[C@](C)(O)c1ccsc1 159964475 KVCBYWHSTXVBCQ-VUCTXSBTSA-N 287.428 3.479 70 20 CGID CC[C@H]1CCCCN1C(=O)NCc1ccc(C)cc1 217315155 KBZGOFJVRQAODH-HNNXBMFYSA-N 260.381 3.469 70 20 CGID O=C(c1cc2ccccc2[nH]1)N1[C@H]2C=CC[C@H]1CC2 218727363 UZVOWANINSXHGS-STQMWFEESA-N 252.317 3.101 70 20 CGID c1ccc2c(CNC[C@@H]3CCN(C4CC4)C3)coc2c1 159817770 VFKIBPZBDJPGGF-ZDUSSCGKSA-N 270.376 3.007 70 20 CGID CCOc1cc(CN[C@H](C)CCSCC)ccc1O 160063417 XDLLCAHOYXDCMQ-GFCCVEGCSA-N 283.437 3.412 70 20 CGID Cn1nccc1COc1ccc(Cl)cc1Cl 161199518 HBQVHYCSQYSYAD-UHFFFAOYSA-N 257.120 3.306 70 20 CGID Cc1nn(C)cc1CN[C@@H](c1ccccc1)c1nccs1 161337525 OJYQDIKETCRJOC-HNNXBMFYSA-N 298.415 3.064 70 20 CGID CC[C@@H](NC(=O)c1occc1C)c1c(C)noc1C 160001575 SDFXFCNYFCAVFG-LLVKDONJSA-N 262.309 3.074 70 20 CGID CCc1ccc([C@H](CC)N[C@H]2CCc3nc(C)nn3C2)cc1 160426743 NEKDMNKCAZWQDU-IRXDYDNUSA-N 298.434 3.205 70 20 CGID CCc1nc(CN[C@@H](c2ccc(F)cc2F)C(C)C)n[nH]1 160503392 KQIORIZXKQJNMQ-OAHLLOKOSA-N 294.349 3.132 70 20 CGID CS[C@H](C)CNC(=O)Nc1ccc(OC(C)C)cc1 160590929 ZCYCTNRQVKTCSU-LLVKDONJSA-N 282.409 3.347 70 20 CGID CCCC1(CN[C@@H](C(=O)OC)c2ccccc2F)CC1 160774648 YCVHBFFEYGBZER-CQSZACIVSA-N 279.355 3.210 70 20 CGID CS[C@@H](C)CC(=O)NCCCCN(C)c1ccccc1 160851748 GVDPGKSYVPORPC-AWEZNQCLSA-N 294.464 3.161 70 20 CGID COC[C@H]1CCCN1C(=O)CC1CCC(C)(C)CC1 160889432 XSKNDXBPKIZRGX-CQSZACIVSA-N 267.413 3.230 70 20 CGID CC[C@H](C(=O)Nc1cccc(F)n1)c1ccc(OC)cc1 160874664 RMKMFCNQSGMMFW-ZDUSSCGKSA-N 288.322 3.362 70 20 CGID Cc1onc(-c2ccccc2)c1C(=O)NC1CC=CC1 160921620 IZOZUTIESPKKBT-UHFFFAOYSA-N 268.316 3.098 70 20 CGID Cc1cc(C)c(C(=O)NCCc2cc3ccccc3[nH]2)[nH]1 159507387 SKESYOCFMVTEDB-UHFFFAOYSA-N 281.359 3.085 70 20 CGID Cc1ccoc1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159369857 IJWXMYMCBNBCKJ-GOEBONIOSA-N 299.370 3.486 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cc(NC(C)=O)ccc1OC 159370178 ANCVNWTULMOVLA-BLLLJJGKSA-N 290.363 3.028 70 20 CGID COCCN1CCC(c2cccc(Br)c2)CC1 217258804 MUIROYJERRYUEV-UHFFFAOYSA-N 298.224 3.275 70 20 CGID Cc1ccccc1[C@H](C)N[C@@H]1CCN2CCCC[C@@H]12 217675128 SRZUNUYAHIYJPN-UAGQMJEPSA-N 258.409 3.272 70 20 CGID C[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccc(F)c1 218437345 UVXXNUQEDVBUJC-IVMMDQJWSA-N 265.372 3.275 70 20 CGID C[C@@H]1CCC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237810 MZQKWZXASZHQSV-MNOVXSKESA-N 299.367 3.110 70 20 CGID c1cnc(Oc2cccc(OCc3nccs3)c2)nc1 161305328 ONRUYWJICPNLST-UHFFFAOYSA-N 285.328 3.304 70 20 CGID Cc1cc(Cl)ccc1OCC(=O)N1[C@@H](C)CC[C@@H]1C 161402115 GHAQFNLUEOUNJO-RYUDHWBXSA-N 281.783 3.427 70 20 CGID Cc1cccc2nc(CNC(=O)C3CCC(C)(C)CC3)cn12 160218261 SLTLGHLHVBEBTC-UHFFFAOYSA-N 299.418 3.475 70 20 CGID CCC(CC)(CC)NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 160537308 PQMFLJLHGFGWPX-ZIAGYGMSSA-N 282.428 3.212 70 20 CGID C[C@H](CCC(=O)NC[C@H]1CCC[C@H](O)C1)c1ccccc1 160771522 ZECAOZBOPODCRB-VYDXJSESSA-N 289.419 3.238 70 20 CGID CC(C)n1cccc1C(=O)Nc1ccc(N(C)C)cc1 160914698 LKQPDGDQGATQCQ-UHFFFAOYSA-N 271.364 3.387 70 20 CGID CCc1nnc([C@H](C)N[C@H](C)c2cccc(F)c2F)o1 159406740 AXRQIKOLQJMERN-BDAKNGLRSA-N 281.306 3.322 70 20 CGID C[C@H](NC(=O)[C@@H]1CC1(C)C)c1cccc(-n2cccn2)c1 159487981 KRUGDMVBDYIQBM-WFASDCNBSA-N 283.375 3.096 70 20 CGID CCS[C@@H]1CCCC[C@@H]1NC(=O)NC[C@@H](C)SC 159491178 QFQDSWVIQRZLJF-GRYCIOLGSA-N 290.498 3.101 70 20 CGID CCc1noc([C@H](C)N[C@@H](C)c2cccc(F)c2F)n1 159513589 NYVJNDLOVBVMPD-IUCAKERBSA-N 281.306 3.322 70 20 CGID Cc1ccc([C@H](Cc2ccccc2)NCCO)cc1C 159717181 MYCBQUXOOIRBAL-SFHVURJKSA-N 269.388 3.169 70 20 CGID C[S@](=O)c1cccc(NC(=O)CCC(C)(C)C)c1 159732441 DJICNHUBNLVVSQ-GOSISDBHSA-N 267.394 3.189 70 20 CGID CCOc1ccc(C(=O)NCC2(C3CC3)CC2)cc1OC 159787503 AXNANWUHXPSHAP-UHFFFAOYSA-N 289.375 3.014 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCCc1cccc(F)c1 217440949 UJZZPZOVFDWREA-OAHLLOKOSA-N 278.371 3.342 70 20 CGID C[C@H]1CCC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237812 MZQKWZXASZHQSV-WDEREUQCSA-N 299.367 3.110 70 20 CGID CN(CCOc1ccc(Cl)cc1)Cc1ccn(C)c1 161156970 ICQCZXLJQNKNOI-UHFFFAOYSA-N 278.783 3.189 70 20 CGID CCOCCC1(C(=O)N[C@H]2CCc3ccccc32)CCC1 161235861 KIHBEBWJEOXWSE-INIZCTEOSA-N 287.403 3.387 70 20 CGID Cc1cccc(CC(=O)N2CCOc3cccc(F)c32)c1 161507113 STDYKJZFHURSIL-UHFFFAOYSA-N 285.318 3.102 70 20 CGID Cc1ccc(NC(=O)NCc2ccc(OC(C)C)cc2)cn1 161508148 XOVQNCVZTRQTTP-UHFFFAOYSA-N 299.374 3.499 70 20 CGID C[C@@H](CNC(=O)C(C)(C)C1CCCC1)CN1CCCC1 160317567 ULXIWACNVGKGMP-AWEZNQCLSA-N 280.456 3.051 70 20 CGID COc1ccc(-c2cncc(C(=O)N(C)C(C)C)c2)cc1 160822110 OQRZHABYDPKZPK-UHFFFAOYSA-N 284.359 3.238 70 20 CGID COc1ccc(N(C)C(=O)c2cccc(F)c2)cc1F 159467220 DTGINIVHRBNJAF-UHFFFAOYSA-N 277.270 3.250 70 20 CGID Cc1ccoc1C(=O)NCCOc1ccccc1Cl 159478914 GZJVJDFTXIIPJC-UHFFFAOYSA-N 279.723 3.050 70 20 CGID O=C(NCCc1nc2ccccc2s1)C1=CCCC1 159687682 HSSKGUXEJVOMQB-UHFFFAOYSA-N 272.373 3.065 70 20 CGID CC(C)CCn1ccc(N[C@H](C)c2cccnc2)n1 159899721 GVGLGPZQUUDVRX-CYBMUJFWSA-N 258.369 3.497 70 20 CGID CCCc1cc(NC(=O)C(C)(CC)CC)n(C)n1 159523440 FLCHCIFACLKCOL-UHFFFAOYSA-N 251.374 3.137 70 20 CGID COc1ccc([C@@H](NC[C@H]2CCCN(C)C2)C2CC2)cc1 217566941 LGHUHRRNRCXRIY-KDOFPFPSSA-N 288.435 3.078 70 20 CGID CSCC[C@H](C)N(C)Cc1noc(-c2ccsc2)n1 160892168 WWALGIOOPFGNIN-JTQLQIEISA-N 297.449 3.372 70 20 CGID COCCCCCS[C@H](C)C(=O)OC(C)(C)C 161336409 WLTAQLDHLWHONN-LLVKDONJSA-N 262.415 3.267 70 20 CGID Cc1cc(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)nn1C 161171799 WCTNBJOBQSHFPC-JTQLQIEISA-N 291.782 3.199 70 20 CGID Cc1cccc(C(=O)Nc2ccc3c(c2)OCCO3)c1F 161383530 MBHSCGGTPHLKLV-UHFFFAOYSA-N 287.290 3.158 70 20 CGID CCCn1nc(C)c([C@@H]2NC(=O)c3cccc(C)c3N2)c1C 160146660 OJXXBQZVOAGFNG-INIZCTEOSA-N 298.390 3.072 70 20 CGID Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 160162047 AXYOQBGZHKXIEW-UHFFFAOYSA-N 380.492 3.605 70 20 CGID Cc1cc(Oc2ccc(NC(=O)C3(C)CC3)cc2)n[nH]1 160471067 UTBKEKJZYMMFBY-UHFFFAOYSA-N 271.320 3.249 70 20 CGID C[C@H](CC(=O)N[C@H]1CCCc2occc21)c1ccncc1 160531690 GPTVZYXKXAYRSD-DOMZBBRYSA-N 284.359 3.362 70 20 CGID CC[C@H](NC(=O)[C@@H]1CCC[C@H](N)C1)c1ccc(F)cc1F 159727133 AYVLEHFBMSYGIZ-GMXABZIVSA-N 296.361 3.050 70 20 CGID C[C@@H]1CC(=O)CC[C@H]1C(=O)NCc1ccc2ccccc2c1 159781106 CFYBLFPHSKYWPK-FZKQIMNGSA-N 295.382 3.461 70 20 CGID C[C@H](NCCSC(F)(F)F)c1cscn1 218232230 DFZCWOGSDOLGSU-LURJTMIESA-N 256.318 3.047 70 20 CGID CC[C@H](C)[C@@H](NCc1cc(F)cc(Cl)c1)C(=O)OC 160873636 CPGAZCDVDHRYEC-TVQRCGJNSA-N 287.762 3.156 70 20 CGID COc1cc(NC(=O)c2ccc(Cl)cc2F)ccn1 218293294 BOVVYXKNWCNTGH-UHFFFAOYSA-N 280.686 3.135 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)Nc2ccc3c[nH]nc3c2)C1 159766692 IFTITLFRGPYCLQ-GHMZBOCLSA-N 257.337 3.328 70 20 CGID O=S(=O)(Cl)[C@H](CC(F)(F)F)c1ccccc1 88251109 YVPWFYFQSOZQAA-MRVPVSSYSA-N 272.675 3.249 70 20 CGID CCCCNC(=O)[C@@H](C)N[C@@H](CC)c1ccc(F)cc1F 161026905 SNASCUAXQMKAQG-ABAIWWIYSA-N 298.377 3.310 70 20 CGID COc1ccc(NC(=O)[C@@H]2[C@H](C=C(C)C)C2(C)C)cc1N 161048806 QEYVMOWZRQAVDD-WFASDCNBSA-N 288.391 3.454 70 20 CGID CCCCN(CCCC)C(=O)Nc1cnc(CC)nc1 161208893 ARYPRWUHOVZMRZ-UHFFFAOYSA-N 278.400 3.473 70 20 CGID O=C([C@@H]1CCCO1)N1C[C@@H]2CCCC[C@]21c1ccccc1 161302204 SBVUBWVFAHJNAV-BQFCYCMXSA-N 285.387 3.093 70 20 CGID CC(C)OCCC(=O)N1CCc2c(Cl)cccc21 161462912 RGAHEZXSPRITMH-UHFFFAOYSA-N 267.756 3.044 70 20 CGID CCCOc1ccc(CNC(=O)C[C@@H](C)SC)cc1 160004830 XIYLKSHDMCQTPL-GFCCVEGCSA-N 281.421 3.233 70 20 CGID COCCC[C@H](C)C(=O)N[C@H]1CCCc2sccc21 160240305 JKNFAKGQNJSKPH-AAEUAGOBSA-N 281.421 3.304 70 20 CGID CCC[C@H](NCc1n[nH]c(CC)n1)c1ccc(F)cc1F 160504087 QPFRYFOXEMGHFR-ZDUSSCGKSA-N 294.349 3.276 70 20 CGID C[C@H](CCc1cccc(C(F)(F)F)c1)NCC(C)(C)O 160625451 PYMJNUXPTFPPDH-LLVKDONJSA-N 289.341 3.387 70 20 CGID C[C@H]1C[C@H](NCC(C)(C)O)c2cccc(Br)c21 160636098 ZBMYGMTYWVCIPS-CABZTGNLSA-N 298.224 3.358 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](C(C)C)C2CC2)c1 160636314 USLXPFHTXZVAJZ-QGZVFWFLSA-N 288.435 3.351 70 20 CGID Cc1ccc(N2CCCC2)c(C(=O)Nc2cccc(F)n2)c1 160804516 UQRGIEJHVRFXPD-UHFFFAOYSA-N 299.349 3.382 70 20 CGID CCc1ccc(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)cc1 160844015 FZHYSNSDWARGJJ-HNNXBMFYSA-N 292.423 3.414 70 20 CGID Cc1c(C(=O)NC[C@@H]2CCC[C@H](C)C2)cnn1CC(C)C 160896373 QXBOVYLPRCMPTG-DZGCQCFKSA-N 291.439 3.404 70 20 CGID CCn1c(SCC2CC2)nc2ccc(F)cc2c1=O 159657425 JSKPHOVVJFXSGG-UHFFFAOYSA-N 278.352 3.058 70 20 CGID Cc1ccc(F)c(C(=O)N[C@H]2CCOC3(CCCC3)C2)c1 159691911 VYETZAVXAYWGCP-ZDUSSCGKSA-N 291.366 3.356 70 20 CGID C[C@H](CNCc1cccc(C2CC2)c1)N(C)C1CC1 217534852 NADOCRHCZKJNIG-CYBMUJFWSA-N 258.409 3.136 70 20 CGID CCc1ncnc(N[C@@H](C)c2ccc(OC)cc2)c1F 217995319 JZYMHKXMQMRGBA-JTQLQIEISA-N 275.327 3.360 70 20 CGID CC(C)(C)[C@@H]1CCN(C(=O)c2ccc3c(c2)NCC3)C1 159553080 JGAOZPCILSGSPG-CQSZACIVSA-N 272.392 3.163 70 20 CGID COc1cc(CNCc2cscc2C)cc2c1OCO2 159908942 YHQHPFQVAULILQ-UHFFFAOYSA-N 291.372 3.084 70 20 CGID C[C@H]1CC/C(=C/C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 809281106 GRAZVZIMLLZSDF-DFYQSJSGSA-N 297.351 3.030 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)c2ccccc2O)C1 161090524 PLURDVNEWSMHHY-ZDUSSCGKSA-N 261.365 3.291 70 20 CGID FC(F)(F)c1cccnc1N[C@H]1CCO[C@H](C2CC2)C1 160356493 AQOBADPRMYLILQ-JQWIXIFHSA-N 286.297 3.470 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N[C@@H]1CCCc2sccc21 160385677 KFDDLFVEHHIAHK-ZKYQVNSYSA-N 291.416 3.247 70 20 CGID Cc1ccc([C@H]2CCCN2C(=O)[C@H]2OCC[C@H]2C)s1 160422492 AJOBEDBLEMNGNE-QKCSRTOESA-N 279.405 3.145 70 20 CGID CC(C)(C)SCCCC(=O)N1CC[C@H]2OCCC[C@H]2C1 160740346 RXPWPRFMEDPJAM-UONOGXRCSA-N 299.480 3.326 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c(F)c1 160889261 RGFWSVBZVSTEMT-LLVKDONJSA-N 280.343 3.213 70 20 CGID CCOCCC1(C(=O)N[C@@H]2CCCC[C@@H]2C)CCC1 160953942 LTKBWGSCWNYRQT-UONOGXRCSA-N 267.413 3.278 70 20 CGID CCc1nc(C(=O)NCc2ccc(Cl)c(C)c2)co1 159844440 PSKVFYQKFGCALA-UHFFFAOYSA-N 278.739 3.129 70 20 CGID CN(C(=O)C[C@H]1CSCCS1)c1ccc(F)cc1 159652333 MSIZMNACNGQQMH-LBPRGKRZSA-N 285.409 3.027 70 20 CGID Cc1c(CN[C@H](C)c2ccc(OC(F)F)cc2)cnn1C 159713408 YBOFAMQINZVVAS-SNVBAGLBSA-N 295.333 3.181 70 20 CGID CCC(C)(CC)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 159378181 OTIWNRCHNMCJKP-MCIONIFRSA-N 279.424 3.277 70 20 CGID CC[C@H](NC(=O)Nc1ccc(F)c(F)c1)[C@@H]1CCCO1 159385380 HHEPKRUEJBLLGP-STQMWFEESA-N 284.306 3.044 70 20 CGID CC[C@H](C)N(C)CCNCc1cc2ccccc2o1 217400839 RTULROWOEVXWLR-ZDUSSCGKSA-N 260.381 3.253 70 20 CGID CN(Cc1ccccc1)C(=O)Nc1ccc(N(C)C)cc1 217311403 HOBXEQBABOQARI-UHFFFAOYSA-N 283.375 3.417 70 20 CGID C[C@H]1CCC[C@@H](CNC(=O)N2CCCCCC2)C1 218050582 ALHUGOBTAWBXRN-UONOGXRCSA-N 252.402 3.398 70 20 CGID C[C@H](N[C@@H](C)C1CC1)c1cnn(Cc2ccccc2)c1 160136928 QIVCIKOLBWHXHU-KBPBESRZSA-N 269.392 3.381 70 20 CGID CC(C)n1ccnc1CN1CC[C@@H](c2ccccc2)C1 160875793 VJJKBFZGSBCJSY-MRXNPFEDSA-N 269.392 3.454 70 20 CGID CC1(C)C[C@@H](Nc2ncccc2C(F)(F)F)CCO1 160654521 WNOMCWBRVOVGJD-VIFPVBQESA-N 274.286 3.470 70 20 CGID CCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CCCCO1 161227742 BYJHNEMXPLBPLH-CQSZACIVSA-N 281.783 3.258 70 20 CGID CCn1cc(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)cn1 161447193 GKELPJCNYROMRI-NWDGAFQWSA-N 275.377 3.015 70 20 CGID COc1ccc2c(c1)[C@H](NCC1(CO)CCCC1)CCC2 160084669 OINYSOYWXPBXCZ-QGZVFWFLSA-N 289.419 3.215 70 20 CGID Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(C(C)C)cc1)CC2 160301914 MGQWKLCXWUSOBZ-SUMWQHHRSA-N 298.434 3.376 70 20 CGID CC1(C(=O)Nc2cccc(OCCF)c2)CCC1 160580181 HRWWTVBBBUFPIB-UHFFFAOYSA-N 251.301 3.164 70 20 CGID CN(C[C@@H](O)C1CC1)C1c2ccccc2-c2ccccc21 160808708 YKHHOTITQBAGSP-GOSISDBHSA-N 279.383 3.459 70 20 CGID N[C@@H]1CCC[C@@H](NC(=O)CCc2ccc3ccccc3c2)C1 160856172 FRGOCIIGAZHECP-QZTJIDSGSA-N 296.414 3.159 70 20 CGID CC[C@@H](C)C(=O)O[C@H](c1ccccn1)C(F)(F)F 159936914 SJHNCOFXMATZFJ-PSASIEDQSA-N 261.243 3.274 70 20 CGID CC[C@@H](Nc1ccc(N(C)C(C)C)c(F)c1)C(=O)OC 159493467 JEHDEEMAQBXQNL-CYBMUJFWSA-N 282.359 3.034 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1ccnc2ccccc12 161466513 BIUGXSWWYHUZPV-LBPRGKRZSA-N 258.365 3.444 70 20 CGID O=C(NOCc1cccnc1)[C@H]1CC[C@@H]2CCCC[C@@H]2C1 161040859 NSBSHOTXLWABEO-XHSDSOJGSA-N 288.391 3.236 70 20 CGID COc1ccc(CN(C)CCCCn2ccnc2C)cc1 161275814 ZWESFWNSFGUGQC-UHFFFAOYSA-N 287.407 3.112 70 20 CGID CCN(CC)CCC[C@H](C)NC(=O)[C@@H]1CCC[C@H](C)C1 161291410 NUIXYWMRUPWTHI-HRCADAONSA-N 282.472 3.439 70 20 CGID Cc1ccoc1C(=O)N[C@@H]1CCCc2sccc21 160104805 TUNSAIWSJVGGPI-LLVKDONJSA-N 261.346 3.457 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@@H]1CCCCO1 160157027 SPXGRKLNCSVXGC-WFASDCNBSA-N 278.348 3.177 70 20 CGID O=C(Cc1c[nH]c2cc(F)ccc12)NCC1(C2CC2)CC1 160227722 UFGYACUDJRWWGX-UHFFFAOYSA-N 286.350 3.156 70 20 CGID CCc1noc(C)c1CS(=O)(=O)c1ccc(Cl)cc1 160337365 KVVWBERSIIRRGV-UHFFFAOYSA-N 299.779 3.173 70 20 CGID C[C@H](NC[C@@H](C1CCCCC1)N(C)C)c1ccco1 160415560 KDDYVOPJAXXMKB-ZFWWWQNUSA-N 264.413 3.441 70 20 CGID CCCCCNC(=O)[C@H](C)c1c(F)cccc1F 160472924 AOTCLRVXFIAIGF-SNVBAGLBSA-N 255.308 3.375 70 20 CGID CCOc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)cc1 160491018 AKQYIZOWUAIIRP-UHFFFAOYSA-N 299.326 3.091 70 20 CGID CC1(C)C[C@H](NC(=O)Nc2c(F)cccc2F)CCO1 160807823 BTXRKYGNNXTNJH-SECBINFHSA-N 284.306 3.044 70 20 CGID Cc1cccc(CCC(=O)NCC2(C3CC3)CC2)c1 159825441 MABVKTZTQYBBQL-UHFFFAOYSA-N 257.377 3.234 70 20 CGID O=C(CCCOc1ccc(F)cc1)NCC1(C2CC2)CC1 159828788 MBHKAYXKVVOTKH-UHFFFAOYSA-N 291.366 3.291 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCC1(C2CC2)CC1 159855610 XGJYUTKOHYAAIW-OLZOCXBDSA-N 275.417 3.466 70 20 CGID COc1ccc(CCCC(=O)NCC2(C3CC3)CC2)cc1 159974285 MCZLKBOEERVZRA-UHFFFAOYSA-N 287.403 3.324 70 20 CGID Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1F 159542520 LPEOROLKYCDQGR-IMJJTQAJSA-N 275.367 3.181 70 20 CGID CC[C@H](C)[C@H](NCc1coc2ccccc12)C(=O)OC 161083652 AGRIRCMZMBGWMY-NHYWBVRUSA-N 275.348 3.110 70 20 CGID Cc1cc(NC(=O)OC(C)(C)C)ccc1S(=O)(=O)F 1887504011 WFNUYSLGZHSDQQ-UHFFFAOYSA-N 289.328 3.000 70 20 CGID Cc1nc(-c2cccc(OCc3nccs3)c2)no1 161263699 DGCOTGYXQXMZGW-UHFFFAOYSA-N 273.317 3.081 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)c1ccccc1C 160014551 CBTRCMPTPVYTJA-MRXNPFEDSA-N 281.355 3.421 70 20 CGID C[C@H]1CCC[C@@H](C(=O)N(C)c2ccc3c(c2)OCO3)C1 160089692 AOZMXTSSQBVREX-NWDGAFQWSA-N 275.348 3.204 70 20 CGID CC[C@@H](OC1CCCCC1)C(=O)Nc1cccc(F)n1 160556438 WUWCOXYWELLBBR-GFCCVEGCSA-N 280.343 3.287 70 20 CGID CCCSCC(=O)N[C@H](CC)c1c(C)noc1C 160752750 VUWLXFJQMAPTAS-LLVKDONJSA-N 270.398 3.002 70 20 CGID Cc1ccccc1[C@H](C)NCCNC(=O)CC1CCCC1 159404477 BSYZHDZLGUEEJR-HNNXBMFYSA-N 288.435 3.342 70 20 CGID Cc1ccccc1[C@H]1C[C@@H](C)N(CCn2ccnc2)C1 159839082 HHKRLIPLENNQRG-CVEARBPZSA-N 269.392 3.070 70 20 CGID O=C(CSc1ccc(F)c(F)c1)NCC1(C2CC2)CC1 159671251 JJNWABUILICRQH-UHFFFAOYSA-N 297.370 3.363 70 20 CGID CS[C@H](C)CC(=O)NCCOc1ccc(C(C)C)cc1 159716916 ABRUHYIQHKAQTG-CYBMUJFWSA-N 295.448 3.447 70 20 CGID Cc1ccc(CNC(=O)c2cnn(CC(C)C)c2C)c(C)c1 159374969 CDBNQZDBTLEOQK-UHFFFAOYSA-N 299.418 3.394 70 20 CGID CCc1noc(C)c1CSCc1noc(C(C)C)n1 159779680 PERPEFVYJJHQAA-UHFFFAOYSA-N 281.381 3.485 70 20 CGID Cc1ccc(Cl)cc1OCc1nnc2n1CCCC2 217323341 SINVJFDSRMVNHW-UHFFFAOYSA-N 277.755 3.155 70 20 CGID CCc1ncnc(NCc2cc(F)ccc2F)c1F 218007544 JRDGBYGUIMMFPW-UHFFFAOYSA-N 267.254 3.068 70 20 CGID C[C@@H]1CCC[C@H](N(C)C(=O)C[C@@H](N)c2ccccc2)C1 218597367 BPQYLHOUZKREBP-VNQPRFMTSA-N 274.408 3.114 70 20 CGID CCC[C@](C)(NC(=O)c1cccc(C)c1Cl)C(=O)OC 160405142 JXDCVNWGSAHXKJ-HNNXBMFYSA-N 297.782 3.110 70 20 CGID COc1ccc(O)c(C(=O)Nc2cnc3ccccc3c2)c1 218463014 SYSQMLNZBJNENE-UHFFFAOYSA-N 294.310 3.201 70 20 CGID CCOCCC1(C(=O)Nc2ccc(OC)cc2)CCC1 161038367 ZHNYUXLQSKCHGC-UHFFFAOYSA-N 277.364 3.231 70 20 CGID CN(C(=O)C(C)(C)CN)c1ccc(-c2ccccc2)cc1 161082437 FPNBDHBVNIRENL-UHFFFAOYSA-N 282.387 3.301 70 20 CGID CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(C)nc1 161491877 JXHOTUSNGFMGKQ-UHFFFAOYSA-N 299.374 3.453 70 20 CGID CSc1ccc(NC(=O)N(C)[C@@H]2CCSC2)cc1 160115833 WMOABIBSGLANTP-LLVKDONJSA-N 282.434 3.378 70 20 CGID O=C(Oc1ccccc1)c1csc([C@H]2CCCO2)n1 160491589 FJJKHTNADPQHFL-GFCCVEGCSA-N 275.329 3.214 70 20 CGID CCCC1(CNC(=O)c2[nH]c(C)c(C(C)=O)c2CC)CC1 160543187 FEIMSNFMVAUTPE-UHFFFAOYSA-N 290.407 3.398 70 20 CGID O=C(/C=C/c1ccc(Cl)nc1)NC[C@H]1CC=CCC1 160708017 USLLPZCLKREQRE-CRALRDPISA-N 276.767 3.221 70 20 CGID CC[C@@H](C(=O)N(C)CCSC)c1ccc(F)cc1 160960757 VEKGFMPZOJDTGU-CYBMUJFWSA-N 269.385 3.141 70 20 CGID COc1ccc(N(C)C(=O)CSC(F)(F)F)cc1F 159833540 CSOQJNBSWMDJCZ-UHFFFAOYSA-N 297.273 3.050 70 20 CGID CCCOc1cccc(CCNC(=O)C2[C@H]3CCC[C@H]23)c1 159724184 AVYCKIRQTAWFTJ-HOTGVXAUSA-N 287.403 3.180 70 20 CGID C[C@@H](Nc1nc(C(C)(C)C)ns1)C1CCOCC1 159984534 BYPJHOLPLSIOJY-SECBINFHSA-N 269.414 3.063 70 20 CGID CS[C@H]1CC[C@@H](Nc2ncnc3c2CCCC3)C1 217808923 HNMWBSWXHWCINW-MNOVXSKESA-N 263.410 3.051 70 20 CGID CCCCCNC(=O)NCCc1ccc(Cl)cc1 217308544 JCOGYSIKADPBFG-UHFFFAOYSA-N 268.788 3.372 70 20 CGID CC(=O)c1ccccc1OCCn1cnc2c1CCCC2 216717669 XVFKZBDQRFTSCU-UHFFFAOYSA-N 284.359 3.044 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)CC1CCN(C)CC1 160045410 HJPOEKPUMMYSBS-UHFFFAOYSA-N 297.487 3.186 70 20 CGID C[C@H](NC[C@@H](C1CCCCC1)N(C)C)c1cncc(F)c1 160412482 IHODBVOJARANFT-GUYCJALGSA-N 293.430 3.382 70 20 CGID CCOc1cccc(CN(C)Cc2cccc(F)c2)n1 160464388 BOQMWNIKZRFLGY-UHFFFAOYSA-N 274.339 3.251 70 20 CGID CC(C)[C@@H]1CCCC[C@@H]1NCCCCN1CCC[C@@H]1CO 160696700 FFMRFNJRHHYRRR-SQNIBIBYSA-N 296.499 3.028 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cccc(NC(=O)C2CC2)c1 160965144 DPLKOUPGLVVSDS-PBHICJAKSA-N 286.375 3.410 70 20 CGID COc1ccc(N(C)C(=O)CC[C@@H]2CC[C@@H](C)O2)cc1F 159456894 FUVGLTHSXYYGLB-YPMHNXCESA-N 295.354 3.145 70 20 CGID Cc1cccc([C@H]2CCCN2CCc2ccncc2)n1 159753968 CSGSNGKLUGMGBF-QGZVFWFLSA-N 267.376 3.165 70 20 CGID Cc1cc(N[C@@H](CO)CC(C)(C)C)nc(C(C)C)n1 161430235 CZXGJFRQFZOJGG-GFCCVEGCSA-N 265.401 3.117 70 20 CGID C[C@@H](NCC(C)(C)NC(=O)OC(C)(C)C)c1cscn1 218266549 WWISMQYEQSGLAH-SNVBAGLBSA-N 299.440 3.097 70 20 CGID CC[C@@H](C)CN(CC)Cc1nc(N)c2ccccc2n1 160567699 TXPSMUYHGOWCHJ-GFCCVEGCSA-N 272.396 3.080 70 20 CGID CN(Cc1ccc(Cl)c(Cl)c1)Cc1ccnn1C 161139688 IAMIDSPPETXZHV-UHFFFAOYSA-N 284.190 3.359 70 20 CGID CC[C@H](C)OC[C@@H](CS(=O)(=O)Cl)C(C)(C)C 114478373 LGKLWQAKOZVSKV-UWVGGRQHSA-N 270.822 3.032 70 20 CGID CC[C@H](N[C@@H](C)C(=O)NC(C)(C)C)c1ccc(F)cc1F 161024881 UKMFEVZJVVPEPG-HZMBPMFUSA-N 298.377 3.309 70 20 CGID C[C@@H](N[C@@H]1CCOc2c(Cl)cccc21)c1cnccn1 161279453 YCLLNLXLOUJZHN-ZWNOBZJWSA-N 289.766 3.304 70 20 CGID Cc1cccc(C(=O)N(C)Cc2ccsc2)c1F 161415015 PRSGCXTWSMFFHB-UHFFFAOYSA-N 263.337 3.468 70 20 CGID CC[C@H](NCCCN(C)C)c1cccc(Cl)c1F 161480379 KNUFYCXHPBIYFA-ZDUSSCGKSA-N 272.795 3.472 70 20 CGID CC1(C)Cc2cccc(CNCC3(CO)CCCC3)c2O1 160067024 PQYCMYPMJBKUKB-UHFFFAOYSA-N 289.419 3.042 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@](C)(CCC)C1 160105337 DIHZPBAWKKFLEX-INIZCTEOSA-N 278.444 3.399 70 20 CGID C[C@@H](NC1CCN(CCc2ccc(F)cc2)CC1)C1CC1 160121856 YWAWCFSNHFWLNK-CQSZACIVSA-N 290.426 3.221 70 20 CGID CCOCCC1(CNC(=O)N[C@H]2CCC[C@H]2CC)CC1 160230271 RPQAFKJBGQGAKF-KGLIPLIRSA-N 282.428 3.071 70 20 CGID CCOCCC1(CNC(=O)N[C@@H]2CCC[C@@H]2CC)CC1 160230699 RPQAFKJBGQGAKF-UONOGXRCSA-N 282.428 3.071 70 20 CGID CCCCn1ncc(NC(=O)NCC2(C)CCC2)c1C 160269835 JHZJSBOBOFFOHW-UHFFFAOYSA-N 278.400 3.303 70 20 CGID Cc1cc(F)ccc1C(=O)N(C)c1ccc2c(c1)OCO2 160281218 FRFJJUINQBFDML-UHFFFAOYSA-N 287.290 3.139 70 20 CGID CC[C@H](C)CN(CC)C(=O)c1ccc(N(C)C)cc1F 160601109 LRHDNKIFFVKBRB-LBPRGKRZSA-N 280.387 3.400 70 20 CGID Cc1ccc(C)c(-n2ncc(NC(=O)NCC3CC3)c2C)c1 160686185 PFBBYVNSRWFLDP-UHFFFAOYSA-N 298.390 3.329 70 20 CGID CC[C@H](COC)NCCCC(=O)Nc1ccc(Cl)cc1 160808671 WJXKHRNNYYLRPM-CYBMUJFWSA-N 298.814 3.073 70 20 CGID CC1(C)CCC(CC(=O)N2CCOCC2(C)C)CC1 160961689 VVXKNJBLHJVIQP-UHFFFAOYSA-N 267.413 3.230 70 20 CGID CCCSCC(=O)N[C@@H]1CCOC2(CCCCC2)C1 160965003 YNQGZPSKXSZYOF-CYBMUJFWSA-N 285.453 3.128 70 20 CGID Cc1cc(C(=O)N(Cc2ccccc2)CC2CCC2)ncn1 159811475 RKPOPNDPVVDRLK-UHFFFAOYSA-N 295.386 3.228 70 20 CGID C[C@H]1C[C@H]1c1cc(NC(=O)c2ccn(C3CCCC3)n2)[nH]n1 159681918 CJARMIJZYVGOFT-CMPLNLGQSA-N 299.378 3.097 70 20 CGID CCCCn1ncc(C(=O)Nc2cc(C)ns2)c1C 159884038 KUZMHRRZQMZUNH-UHFFFAOYSA-N 278.381 3.009 70 20 CGID CCCC[C@@H](CCC)NC(=O)N1CCCN(CC)CC1 159947637 FIIUCRQFLVGGAG-OAHLLOKOSA-N 283.460 3.083 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(C)n(CC)c1C 159577683 TUVZHTMGMCISSN-DZGCQCFKSA-N 262.397 3.433 70 20 CGID CCOCCC1(CN[C@H](C)c2cccnc2)CCC1 159978714 CNPBJVAHVSXJGP-CQSZACIVSA-N 262.397 3.329 70 20 CGID Fc1cc(Cl)cc(CN2CCC([C@H]3CCCN3)CC2)c1 161138444 KHYBAZMFKJPFDC-MRXNPFEDSA-N 296.817 3.443 70 20 CGID Cc1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](C)C2)c(F)c1 218674153 DGOLAIPTXRGWEF-CHWSQXEVSA-N 278.371 3.193 70 20 CGID c1ccc2c(c1)C[C@@H](CNCc1cccc3cc[nH]c13)O2 218089620 JKSAADIVVMCOBJ-INIZCTEOSA-N 278.355 3.261 70 20 CGID Cc1ccccc1NC(=O)N(C)CCc1nccs1 159721934 QPXVPWXCCKENNC-UHFFFAOYSA-N 275.377 3.158 70 20 CGID CCc1ccc(/C=C/C(=O)N2C[C@H]3CCC[C@H]3C2)o1 161003357 XGTOYLLOPXLQOI-UVHIWXSVSA-N 259.349 3.114 70 20 CGID O=C(NC1CCC(c2ccccc2)CC1)[C@H]1CCCCO1 161046559 UKYPSIWWZJXAHQ-OFLPRAFFSA-N 287.403 3.398 70 20 CGID CCN(Cc1cnn(C)c1)Cc1ncc(-c2ccccc2)o1 161086331 FHEZPBHYZNSQOC-UHFFFAOYSA-N 296.374 3.097 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccccc2F)c1C 161170032 IMFKENLIPIVKNU-UHFFFAOYSA-N 275.327 3.301 70 20 CGID Cc1ccccc1CNC(=O)[C@@H](C)Sc1ccncc1 160004374 MBLAMBNHRSOITH-CYBMUJFWSA-N 286.400 3.187 70 20 CGID c1ccc([C@H]2C[C@@H](Nc3ccccn3)CCO2)cc1 160629819 RWAGVDPTYJPTOJ-LSDHHAIUSA-N 254.333 3.414 70 20 CGID CCCS(=O)(=O)N1CCCCC[C@@H]1c1ccc(C)o1 160637946 DXBDGRIDRNDOCP-CYBMUJFWSA-N 285.409 3.245 70 20 CGID Cc1cc(NC(=O)N(C)[C@H]2CCSC2)ccc1N(C)C 160692933 BRYGGTCYJZBAMX-ZDUSSCGKSA-N 293.436 3.030 70 20 CGID COc1cccc([C@H](C)CC(=O)Nc2cccc(F)n2)c1 160846819 SCQKYDOUMLWVMZ-LLVKDONJSA-N 288.322 3.362 70 20 CGID CC[C@H](C(=O)Nc1ccc(OC(C)(C)C)cc1)N(C)C 159444423 MEEROHNAKSBOIB-CQSZACIVSA-N 278.396 3.143 70 20 CGID CCOc1ccccc1NC(=O)N[C@@H](CC)[C@H]1CCCO1 159455808 CIBKWADHGFLFTK-GXTWGEPZSA-N 292.379 3.164 70 20 CGID CCCc1nc(CNCC(CC)(CC)C(=O)OC)cs1 159670353 GJMGKQYEJKTYFP-UHFFFAOYSA-N 298.452 3.165 70 20 CGID CCC(CC)C(=O)NCCc1cc2ccccc2[nH]1 159559400 XSSXGHZDDORXDW-UHFFFAOYSA-N 258.365 3.263 70 20 CGID CCOc1cc(Cl)ccc1CNC(=O)N(CC)CC 159977994 GIILCSMKADCUDT-UHFFFAOYSA-N 284.787 3.290 70 20 CGID CC[C@@H](N[C@@H](C)c1cccc(OC(C)C)c1)C(=O)OC 159504055 FZYYFGYYBAVXAR-SWLSCSKDSA-N 279.380 3.076 70 20 CGID CCCCOC(=O)CCN[C@H](c1ccccc1)C1CC1 218174066 JFQQVRYVIIRRTK-QGZVFWFLSA-N 275.392 3.461 70 20 CGID CS[C@H]1CC[C@H](Nc2ncnc3c2CCCC3)C1 217809082 HNMWBSWXHWCINW-QWRGUYRKSA-N 263.410 3.051 70 20 CGID CCCCNC(=O)[C@H](C)N[C@H](CC)c1ccc(F)cc1F 161027279 SNASCUAXQMKAQG-XHDPSFHLSA-N 298.377 3.310 70 20 CGID Cc1ccc(C)c(Cn2ccc(C(=O)OC(C)C)cc2=O)c1 161068579 KCENRCQUHPOAJV-UHFFFAOYSA-N 299.370 3.079 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@H](C)C[C@@H]2CCCO2)c1 160010260 GDQFKXQXFRRANK-IPYPFGDCSA-N 293.407 3.312 70 20 CGID Cn1cc(CCC(=O)NCC2(C3CC3)CC2)c2ccccc21 160172987 CVTVHMAKJOPFER-UHFFFAOYSA-N 296.414 3.417 70 20 CGID O=C(C[C@H]1CSCCS1)N1CCC[C@@H]1C1CCCC1 160251967 YHOQRAYEWUOFQF-UONOGXRCSA-N 299.505 3.406 70 20 CGID CN(Cc1cccn1C)C(=O)/C=C/c1ccc(Cl)cc1 160351040 LQFHIXPMHPVYDY-JXMROGBWSA-N 288.778 3.350 70 20 CGID Cc1ccc(CCNC(=O)C[C@H](C)c2ccncc2)cc1 160454267 KZYSJQKFAHEECB-HNNXBMFYSA-N 282.387 3.243 70 20 CGID C[C@H]1CCCN(CCCCNC(=O)[C@@H]2CCC[C@@H](C)C2)C1 160634904 JVNILEALBWWLID-IXDOHACOSA-N 294.483 3.441 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)c1cc(Cl)c[nH]1 160729806 IPTPVQKORXFVBL-QMMMGPOBSA-N 296.779 3.121 70 20 CGID COC[C@@H]1CCCN1C(=O)C[C@H](C)c1ccc(F)cc1F 160882802 ZAYHBKQPKICQER-AAEUAGOBSA-N 297.345 3.096 70 20 CGID CCSc1cccc(-c2nc([C@H]3CCOC3)no2)c1 160888160 KHHQSTVMYAGHDO-NSHDSACASA-N 276.361 3.353 70 20 CGID O=C([C@@H](NC1CC=CC1)c1ccccc1)N1CCCCC1 160894516 WUYNEDKRCWHQFA-KRWDZBQOSA-N 284.403 3.048 70 20 CGID CCOC[C@H]1CCN(C(=O)c2cc(C)cc(Cl)c2)C1 159451023 WILHJHGDBRPUTH-LBPRGKRZSA-N 281.783 3.147 70 20 CGID CCCN(Cc1ccncc1)[C@@H](C)C(=O)Nc1ccccc1 159962826 SJJQAJIYHLSRRF-HNNXBMFYSA-N 297.402 3.321 70 20 CGID CC[C@@H](NC(=O)Nc1c(F)cccc1F)[C@H]1CCCO1 159380198 MSZXMBNMIXTECK-VXGBXAGGSA-N 284.306 3.044 70 20 CGID COCCC(C)(C)C(=O)N[C@H]1CCCc2sccc21 159984319 OUQIDISMYSDVLH-LBPRGKRZSA-N 281.421 3.304 70 20 CGID COCc1nc(C)c(C(=O)NC[C@H]2CCCC[C@@H]2C)s1 159984922 QRXHYTNQLBBIHP-CMPLNLGQSA-N 296.436 3.154 70 20 CGID CCSCCN(Cc1ccco1)C[C@H]1CCCO1 159584579 HVBNTVMYQCCIIW-CQSZACIVSA-N 269.410 3.014 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)C(C)(C)Oc1ccc(F)cc1 161467288 XMFYWQQNHRHZME-TXEJJXNPSA-N 279.355 3.383 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)C[C@@H]1C=CCC1 160103416 AFBPRJVYNKNPGV-IUODEOHRSA-N 271.360 3.155 70 20 CGID O=C(C[C@H]1C=CCC1)N[C@H]1CCOC2(CCCCC2)C1 160402140 ITDKRSBVDUCOSG-GJZGRUSLSA-N 277.408 3.341 70 20 CGID CCC(CC)CNC(=O)N1CCC[C@H]1CN1CCCCC1 160575615 GNIJVZQINYXWJH-INIZCTEOSA-N 295.471 3.083 70 20 CGID C[C@H](NCC(C)(C)O)c1ccc(SCC(F)F)cc1 160590342 IRTFTLKPVLBFQS-JTQLQIEISA-N 289.391 3.465 70 20 CGID CCc1ccc(NC(=O)N[C@H]2CCOC(C)(C)C2)cc1 160842204 KCTPEKPXBBPYMC-AWEZNQCLSA-N 276.380 3.328 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2ccnc(F)c2)CC1 160966281 NWIXSVJUDJTKBZ-UHFFFAOYSA-N 262.328 3.039 70 20 CGID C[C@@H](C(=O)Nc1cccc([S@@](C)=O)c1)c1ccsc1 159740812 QASIKKXOBLFVLL-DGIBIBHMSA-N 293.413 3.228 70 20 CGID CCCC1(CNC(=O)NC2C[C@H](C)O[C@@H](C)C2)CCC1 159956807 IOUQVXMXRIAKIE-STQMWFEESA-N 282.428 3.212 70 20 CGID O=C(CC1CC1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 159383403 BFWOPOSHHRMXAZ-ZBFHGGJFSA-N 273.376 3.071 70 20 CGID c1cc2c(c(CNCCOC3CCCC3)c1)NCCC2 159416495 GMSYFWMNKCKSJO-UHFFFAOYSA-N 274.408 3.094 70 20 CGID COc1cc(OC)nc(N[C@H]2CCCc3sccc32)n1 159786614 OZZWOLNHJMGOEH-JTQLQIEISA-N 291.376 3.045 70 20 CGID Cc1cccc(C(=O)NCc2ccc(F)c(F)c2)c1F 161437954 QPCGTKSSYMRBKI-UHFFFAOYSA-N 279.261 3.342 70 20 CGID C[C@@H]1CCC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)C1 218630436 PEZRJATXXMRQAX-PWSUYJOCSA-N 287.812 3.197 70 20 CGID CC(C)(C)NC(=O)NCCc1cccc(Br)c1 217313532 FRDRWQJSKHSREC-UHFFFAOYSA-N 299.212 3.089 70 20 CGID CC[C@@H](C)[C@H](C)N(C(=O)NCC1(CCOC)CC1)C1CC1 161147652 OTYQMACHWQJJRG-KGLIPLIRSA-N 296.455 3.412 70 20 CGID CCOC[C@@H](O)CN[C@H](CC(C)C)c1ccccc1C 161378528 AAJPCVMATXGNCY-DOTOQJQBSA-N 279.424 3.069 70 20 CGID Cc1ccc(NC(=O)N[C@@H](C)c2ccccc2)cn1 161411043 KGVYILNCTWDCDM-LBPRGKRZSA-N 255.321 3.273 70 20 CGID Cc1ncccc1C(=O)N1CCc2c(Cl)cccc21 161441079 HHOQVYXZDLBUNR-UHFFFAOYSA-N 272.735 3.246 70 20 CGID CCCC[C@@H](CC)CNC(=O)N[C@H]1CC[C@@H](CO)CC1 161470289 LGCMPXUJXUOVSW-RBSFLKMASA-N 284.444 3.053 70 20 CGID Cc1cccc(C(=O)N(C)CCC(F)(F)F)c1F 161477755 ZOIXAJXFPACRGE-UHFFFAOYSA-N 263.234 3.159 70 20 CGID CC[C@H](C)OCC(=O)Nc1cc(Cl)ccc1N(C)C 161501150 YWNJZLCYHDLZQS-JTQLQIEISA-N 284.787 3.160 70 20 CGID CC(C)CN(C(=O)COc1ccc2[nH]ccc2c1)C1CC1 160041554 GJUQYWUTLKBJOF-UHFFFAOYSA-N 286.375 3.194 70 20 CGID CC[C@@H](NC(=O)Cc1cccs1)c1c(C)noc1C 160117922 OPEFDUBIPUYAQV-GFCCVEGCSA-N 278.377 3.163 70 20 CGID C[C@H](c1ccccn1)N1CCO[C@H](CCc2ccccc2)C1 160278218 OCEJALXDSUSTOU-SJLPKXTDSA-N 296.414 3.476 70 20 CGID CCc1nc2cc(NC(=O)CO[C@H](C)CC)ccc2o1 159461596 BOYJCGNOFIOITG-SNVBAGLBSA-N 276.336 3.144 70 20 CGID CC1(C)CCN(CC2CCN(C(=O)C(C)(C)C)CC2)C1 159904450 JVCPKOZYPNFBRE-UHFFFAOYSA-N 280.456 3.003 70 20 CGID CC[C@@H](C(=O)Nc1ccnc2ccnn12)c1ccc(F)cc1 159726374 AUHXNNSPUKRVDS-CYBMUJFWSA-N 298.321 3.001 70 20 CGID CCC[C@@H](C)CC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 159550192 YBHCSAABCZXJIO-BFYDXBDKSA-N 291.435 3.484 70 20 CGID O=C(CC1CC1)N[C@H](C[C@H]1CCOC1)c1ccccc1 159383267 BFWOPOSHHRMXAZ-GDBMZVCRSA-N 273.376 3.071 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)Cc1ccc(OC)cc1 159396278 PUDGQIYJGWEUCA-GOEBONIOSA-N 261.365 3.090 70 20 CGID C[C@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCC1CC1 217987601 FXGZZLVHUAHRNN-SUMWQHHRSA-N 296.455 3.460 70 20 CGID CSCC[C@@H](C)N(C)C(=O)C[C@@H]1CNc2ccccc21 161250477 QMXADYUSXUBEDA-CHWSQXEVSA-N 292.448 3.186 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)Cc1c(C)noc1C 161027195 LXTOIONPKGHFMQ-ZFWWWQNUSA-N 278.396 3.261 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)c2cc(N(C)C)ccn2)C1 161029099 SXJBHHNDRWFZSJ-CQSZACIVSA-N 289.423 3.046 70 20 CGID Cc1ccc(F)c(OCC(=O)N2CCC[C@@H]3CCC[C@@H]32)c1 161329079 KLLKQHFISHGRJH-ZFWWWQNUSA-N 291.366 3.304 70 20 CGID CCCCC[C@H](C)NC(=O)c1cc(OC)c(O)c(OC)c1 161367651 PKJSOIGOLYZHIU-NSHDSACASA-N 295.379 3.108 70 20 CGID CCCCOCC(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C 161467049 GISPCSXYYMTLGT-UHFFFAOYSA-N 291.351 3.042 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(Cl)s1 160230544 JZZAMDDEXNDUDI-UHFFFAOYSA-N 255.770 3.322 70 20 CGID COc1ccccc1-c1nnc(CN(C)CC(C)(C)C)o1 160316073 YUWMTLXZJYHQBU-UHFFFAOYSA-N 289.379 3.223 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(NC(C)=O)ccc1F 160929604 PXAWMNPGLNRBSR-NHYWBVRUSA-N 278.327 3.159 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc(Cl)o1 159414238 RSLCLAWLLYGHTL-SNVBAGLBSA-N 283.755 3.155 70 20 CGID C[C@H]1CCC[C@@H](N(C)C(=O)c2ccc(CN(C)C)cc2)C1 159908588 CGHIXZSOPQFFCR-WMLDXEAASA-N 288.435 3.399 70 20 CGID Cc1ccc([C@H]2CCCCN2C(=O)[C@H]2CCCNC2)cc1 159913752 WJYFXUMTEXSULR-DLBZAZTESA-N 286.419 3.048 70 20 CGID COc1ccc(Cl)cc1N[C@@H](C)CCn1cccn1 159388366 RPFJKOKNEAVSDQ-NSHDSACASA-N 279.771 3.436 70 20 CGID C[C@H]1CCC[C@@H](CNCc2nc3ccccc3n2C)C1 218133739 RYJVBHJIKYGBKJ-UONOGXRCSA-N 271.408 3.489 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCC[C@@H](OC)C2)cc1 160108360 CQBUVDIMPBWJCJ-DUVNUKRYSA-N 263.381 3.303 70 20 CGID C[C@@]1(CNC(=O)NCC2(C3CC3)CCC2)CCCS1 160279051 BLLUALGPUJNPJS-AWEZNQCLSA-N 282.453 3.152 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)Cc1c(C)nn(C)c1C 161282813 AMZVEYYBXVLIFT-GDBMZVCRSA-N 291.439 3.007 70 20 CGID CC(C)Oc1cncc(C(=O)N2CCC[C@H]3CCC[C@H]32)c1 161318758 CTFIVJKUOPKJSD-CZUORRHYSA-N 288.391 3.274 70 20 CGID CC1(C)CCC(C(=O)N[C@H]2CCN(C3CCCC3)C2)CC1 160083863 MILZXVYURLWPKM-HNNXBMFYSA-N 292.467 3.336 70 20 CGID CC[C@H]1CCCC[C@H]1NC(=O)c1ccc(CN(C)C)cc1 160101418 OKRMOKXCFNFMPZ-DOTOQJQBSA-N 288.435 3.447 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nn1cnc2ccccc21 160385206 JJXFSSXETQJUPU-NEPJUHHUSA-N 297.383 3.280 70 20 CGID CCC[C@H](C(=O)NCc1ccc2c(c1)OCO2)C(C)C 160446911 WNSMSUMIOPXHRS-ZDUSSCGKSA-N 277.364 3.104 70 20 CGID CCC[C@@H](N[C@H]1CCc2nc(C)nn2C1)C1CCCCC1 160462988 WEHULPRFAGJZPS-JKSUJKDBSA-N 290.455 3.240 70 20 CGID CC(C)c1ccc(CN(C)C(=O)[C@H]2CCCCO2)cc1 160828997 PGVSCHRVUNKUHN-MRXNPFEDSA-N 275.392 3.338 70 20 CGID CC[C@H](C)[C@H](NCc1ccc(C)nc1)C(=O)OC(C)(C)C 160947493 NDLYIZHROBYQMC-WFASDCNBSA-N 292.423 3.236 70 20 CGID C[C@@](O)(CN[C@@H]1CCc2cc(F)ccc21)c1ccsc1 159871714 HVZAXYVJBWLNFH-HZPDHXFCSA-N 291.391 3.372 70 20 CGID Cc1nc2ccccn2c1CSc1ccncc1 159994221 TVKNUQRKXGGVDX-UHFFFAOYSA-N 255.346 3.330 70 20 CGID C[C@H]1C[C@H]1c1ccc(CNC[C@@H](O)c2ccccc2)o1 217635095 WGWANKXRIJLYKD-APHBMKBZSA-N 271.360 3.226 70 20 CGID COc1cc(CN(C)CCOCC2CC2)ccc1SC 159814275 JLRBERPVLDMHRW-UHFFFAOYSA-N 295.448 3.276 70 20 CGID CCOCCC1(C(=O)Nc2cccc(C(C)=O)c2)CCC1 161043881 WXKURAYXFCKBLC-UHFFFAOYSA-N 289.375 3.425 70 20 CGID CC[C@@H](C)[C@H](C)NC(=O)c1ccc(N(C)C)cc1F 161056284 MFBFRNYHULDZER-MNOVXSKESA-N 266.360 3.056 70 20 CGID CCCN(CCO)Cc1cc(Cl)c(OC)cc1Cl 161236893 PHHAIEMYNFYEMY-UHFFFAOYSA-N 292.206 3.206 70 20 CGID CCCn1nc(C)c(C(=O)NCCCc2ccccc2)c1C 161237840 PLSSAPAKZOETIT-UHFFFAOYSA-N 299.418 3.273 70 20 CGID Cn1nccc1COc1c(Cl)cccc1Cl 161245180 LRGHESSTJSFDBE-UHFFFAOYSA-N 257.120 3.306 70 20 CGID O=C(c1ccoc1)N1CC[C@H](Oc2ccccc2Cl)C1 161375986 YMYWQHAAIBZMCI-LBPRGKRZSA-N 291.734 3.227 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cc(Cl)c2c(c1)OCO2 161424942 FEFCAYBYMUQMLC-RKDXNWHRSA-N 281.739 3.082 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(F)cc1C 160125968 KMZUCCQXOBPVRQ-UHFFFAOYSA-N 282.359 3.054 70 20 CGID C[C@H]1CCCN(C(=O)N[C@H](C)c2ccsc2)C1 160524940 SBXGHYSBUBAOQM-WDEREUQCSA-N 252.383 3.251 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)C(=O)NCc1cccs1 160546532 GONRVGPANQWDLT-OLZOCXBDSA-N 282.453 3.121 70 20 CGID CC(C)C[C@H](CO)NC(=O)CC[C@H](C)c1ccccc1 160709750 OXWSLMTYWCNLOV-GOEBONIOSA-N 277.408 3.094 70 20 CGID O=C(NC1CC=CC1)[C@H]1CCCC[C@H]1C(F)(F)F 160906011 PFBUVYCWBFQZKT-WDEREUQCSA-N 261.287 3.190 70 20 CGID CC(C)CCO[C@@H](C)C(=O)N[C@@H]1CCOC2(CCCC2)C1 159458833 CANRVBCEFRVBFX-LSDHHAIUSA-N 297.439 3.046 70 20 CGID COc1c(F)cc(NC(=O)N2CC[C@@H](C)[C@H](C)C2)cc1F 159737603 WKYCILBBGUKOAH-NXEZZACHSA-N 298.333 3.483 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)C[C@H]1CCCOC1 159973700 VDDUKZWZULGIJZ-CQSZACIVSA-N 284.444 3.271 70 20 CGID Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)s1 159623161 GQVJJKYAFWSDKV-MJBXVCDLSA-N 263.406 3.104 70 20 CGID CC(C)OCCNC1[C@H]2CC[C@H]1Cc1ccccc1C2 160048077 YKJILPODOJSONX-IRXDYDNUSA-N 273.420 3.195 70 20 CGID COc1ccc([C@@H](C)NC[C@H]2CCC(C)(C)O2)cc1 160310670 WITLAQFFODSSDJ-IUODEOHRSA-N 263.381 3.303 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)N(C)CCC1CC1 161026021 WNXQVWQYPKWWMG-SNVBAGLBSA-N 264.369 3.044 70 20 CGID COc1cc(NCC(=O)Nc2ccc(F)cc2)ccc1F 160288374 GDQXNIOEJZDKPS-UHFFFAOYSA-N 292.285 3.024 70 20 CGID C[C@@H](CC(=O)N(C)Cc1cccn1C)c1cccc(F)c1 160819406 NLJUXKOAQPADOZ-ZDUSSCGKSA-N 288.366 3.316 70 20 CGID CCC[C@H](CCc1ccccc1)NC(=O)C[C@@H]1CCCN1 160938707 IDAMUDZHLPROPH-SJORKVTESA-N 288.435 3.046 70 20 CGID CC[C@H](C)OCC(=O)Nc1cc(F)ccc1NC(C)C 159619546 GMQGXTJSLPGXAF-NSHDSACASA-N 282.359 3.400 70 20 CGID Cc1cc(N[C@@H](C)c2nc(-c3cccs3)no2)nn1C 159666722 DAEKQIXCJHMIAO-VIFPVBQESA-N 289.364 3.013 70 20 CGID COc1ccc(CN(C)C(=O)c2ccc(C(C)C)nc2)cc1 159798309 JQSNMMVJBIPCOI-UHFFFAOYSA-N 298.386 3.486 70 20 CGID NC(=O)c1cc(NCc2cc(Cl)ccc2F)ccc1F 160718151 FLJGHIUFKJYCKA-UHFFFAOYSA-N 296.704 3.329 70 20 CGID CC(C)[C@H](CCO)NC(=O)c1cc2c(s1)CC[C@@H](C)C2 160746711 OMRCYZMQRVEKRW-YPMHNXCESA-N 295.448 3.010 70 20 CGID NC(=O)c1ccc(NCc2cc(F)cc(Cl)c2)cc1 160801536 WFNZUGLDBPGRSB-UHFFFAOYSA-N 278.714 3.190 70 20 CGID O=C(NCCc1ccc(F)cc1)Nc1cc(Cl)ccn1 217533932 HKAPHCDWPJYDRT-UHFFFAOYSA-N 293.729 3.238 70 20 CGID C[C@H](NC[C@@H](C)N(C)Cc1ccccc1)c1ccco1 160876169 LCEKSWFGMVROKQ-CABCVRRESA-N 272.392 3.451 70 20 CGID O=C(CC[C@H]1CCCCO1)N1CCc2c(F)cccc2C1 161098714 UNGRILGNRZFADL-CQSZACIVSA-N 291.366 3.060 70 20 CGID CCCn1nc(C)c(C(=O)Nc2cccc(C)c2)c1C 161137042 RGYAPPFNWHUXOS-UHFFFAOYSA-N 271.364 3.471 70 20 CGID C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)[C@@H]1CC=CCC1 161205107 DKAJFFSQYOHQSZ-GXTWGEPZSA-N 289.350 3.260 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1ccc(OC)cc1OC 160136776 CNUONRHGRRMYSV-KBPBESRZSA-N 294.439 3.085 70 20 CGID Cc1nnc(NC(=O)C[C@@H](C)c2ccc(F)cc2F)s1 160161285 IBJOYOFDLMHEIC-SSDOTTSWSA-N 297.330 3.257 70 20 CGID C[C@H]1CCC[C@H](C)N1C(=O)Cc1cc(F)c(F)cc1F 160222451 MVUKGURKYDZCTC-UWVGGRQHSA-N 285.309 3.436 70 20 CGID C[C@@H](CC(=O)NCc1ccn(C)c1)c1ccc(F)cc1F 160424308 WJJMFJMGHUIHRM-NSHDSACASA-N 292.329 3.113 70 20 CGID Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@H]1CCCC[C@@H]1O 160566016 YRAGODPFIURBNA-BJJXKVORSA-N 293.455 3.148 70 20 CGID CC(C)CSCCCNC(=O)/C=C/c1cncc(F)c1 160747256 AQFREIUXQUPTCH-SNAWJCMRSA-N 296.411 3.129 70 20 CGID Cc1ccccc1C(=O)N[C@@H](C)CC(=O)c1cccs1 160861193 DJFQCRGYTXZSHX-LBPRGKRZSA-N 287.384 3.448 70 20 CGID CC[C@H](C)OCC(=O)N1CCC[C@@H]1c1cccc(F)c1 159871359 CJPSMKCBSGGLKX-SWLSCSKDSA-N 279.355 3.304 70 20 CGID CC[C@H](NC(=O)Nc1c(C)cccc1C)[C@H]1CCCO1 159485257 MAFGFIXTZUPROC-UONOGXRCSA-N 276.380 3.383 70 20 CGID COc1ccc(N(C)C(=O)c2cccc(C)c2)cc1F 159734778 DJQIITVOJQMCFW-UHFFFAOYSA-N 273.307 3.419 70 20 CGID C/C=C(\C)C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1 159397823 KJIMXMSDZOSRDE-JXDHDYMSSA-N 274.364 3.120 70 20 CGID O=S(=O)(Cl)CCc1ccc(Cl)cc1Cl 104673347 AQEUFVCDJDUYDX-UHFFFAOYSA-N 273.568 3.105 70 20 CGID C[C@@H]1CCCC[C@@H]1CNC(=O)C[C@@H](N)c1ccccc1 218460361 GDZOCIUQGYHYGB-FVQBIDKESA-N 274.408 3.019 70 20 CGID CC[C@H](C)[C@H](C)NC[C@@H](O)COc1cc(C)ccc1C 218778325 URMSHROIIAAAJR-CWRNSKLLSA-N 279.424 3.067 70 20 CGID CC[C@@H](C)[C@@H](NCc1cc(Cl)ccc1F)C(=O)OC 160743847 WMLRIVADRFVZEB-NOZJJQNGSA-N 287.762 3.156 70 20 CGID Cc1ccc(CCNC(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 217225166 AQUHKKHLNNDQRN-HUUCEWRRSA-N 274.408 3.225 70 20 CGID CCn1ccnc1CN1CCC[C@@H]1c1ccccc1 160738731 UCKAFTHIAVNGRF-OAHLLOKOSA-N 255.365 3.240 70 20 CGID COc1ccc(CN(C)C(=O)Nc2ccc(C)nc2)cc1 161413681 FMZIZUPABSVEEI-UHFFFAOYSA-N 285.347 3.063 70 20 CGID COc1cccc(OC)c1C(=O)Nc1ncccc1Cl 161475087 PRFJXILBRUDWLC-UHFFFAOYSA-N 292.722 3.005 70 20 CGID C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)[C@@H]1CCCCO1 160848790 VXPBNOBMWFWVEI-YOEHRIQHSA-N 287.403 3.383 70 20 CGID CCCCn1ncc(C(=O)N[C@H]2CCCC[C@H]2C)c1C 159637023 JKNHUJKGEUJGTJ-DOMZBBRYSA-N 277.412 3.300 70 20 CGID CCC1(CNC(=O)NCC2(C3CC3)CCC2)CC1 159452578 UFETWWUWHWABFQ-UHFFFAOYSA-N 250.386 3.056 70 20 CGID CCC(CC)(CC)CNC(=O)N[C@@H](COC)c1ccco1 159869135 GZKQAPQWMYKFPI-ZDUSSCGKSA-N 296.411 3.483 70 20 CGID C[C@H](NC(=O)[C@H](C)Cc1cccc(Cl)c1)C1CC1 159701962 WFOSXBQCSZVCLY-MNOVXSKESA-N 265.784 3.433 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc2cc(F)ccc2o1 159718051 VPFNMGCSNZESNT-UHFFFAOYSA-N 273.307 3.492 70 20 CGID Cc1ccc(C(=O)NC2(C)CCC2)cc1Br 159944566 XSPPNHNXBDWMBV-UHFFFAOYSA-N 282.181 3.430 70 20 CGID O=C(NCc1ccc(CO)cc1)Nc1ccc(Cl)cc1 217272406 QNWLRGPZHUCGCO-UHFFFAOYSA-N 290.750 3.154 70 20 CGID C[C@@H](NC(=O)C[C@H]1CCCCC1(C)C)C(=O)NC(C)(C)C 161095900 UNQZIALQKOOLGT-CHWSQXEVSA-N 296.455 3.012 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@H](CC(C)C)C1 161231074 GTIANRRZVSXSDD-OAHLLOKOSA-N 278.444 3.255 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CC2(C)C)o1 161414449 VSRARNCKLKWJFQ-CHWSQXEVSA-N 277.364 3.136 70 20 CGID Cc1cccc(NC(=O)c2ccccc2OCC2CC2)n1 160342005 SVMITRWOGJCGNG-UHFFFAOYSA-N 282.343 3.431 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(SC)cc1 160440934 XPHQMCWEFDIUHL-UHFFFAOYSA-N 296.436 3.329 70 20 CGID CC(C)n1cccc1C(=O)NCCc1ccc(F)cc1 160946298 ISJDZHZGIOIBAO-UHFFFAOYSA-N 274.339 3.181 70 20 CGID COc1ccc(OC)c(NC(=O)N[C@H](C)C2CCC2)c1 159416563 WTPPRQPKQSUNPA-SNVBAGLBSA-N 278.352 3.014 70 20 CGID OCCN(Cc1ccccc1)Cc1ccc(F)c(Cl)c1 218312548 ZVXPEVPQVBSQLW-UHFFFAOYSA-N 293.769 3.474 70 20 CGID NC1(CNC(=O)c2csc3c2CCCC3)CCCCC1 159559832 WFYQBNNOZWTIJW-UHFFFAOYSA-N 292.448 3.018 70 20 CGID CC1(C)C[C@H](NCc2ccc3ncccc3c2)CCO1 160443919 HBJCHMSBGUSAFD-OAHLLOKOSA-N 270.376 3.282 70 20 CGID Cc1nccn1CCCCN(C)[C@H](C)c1ccco1 161502247 NEJWZGIWLJCJCI-CYBMUJFWSA-N 261.369 3.258 70 20 CGID CC[C@H](S[C@H](CC)C(N)=O)c1ccc(F)cc1F 161363537 LLTQUXLLAQCAMQ-NWDGAFQWSA-N 273.348 3.413 70 20 CGID CC[C@H](S[C@H](C)C(N)=O)c1ccc(F)cc1F 161368944 BTUZDTSKULQFHR-HQJQHLMTSA-N 259.321 3.023 70 20 CGID CCCCn1ncc(NC(=O)NC[C@@H]2CC=CCC2)c1C 160061270 AVCNKSDSLQJLTE-CQSZACIVSA-N 290.411 3.469 70 20 CGID C[C@H]1CC(NC(=O)NCC2CCC(C)(C)CC2)C[C@H](C)O1 160321473 KIGYJYPFMGICGV-STQMWFEESA-N 296.455 3.458 70 20 CGID Cc1oc(C)c(C(=O)N(C)c2ccc3c(c2)OCO3)c1C 160357271 RBJOMNQBOIZQOA-UHFFFAOYSA-N 287.315 3.210 70 20 CGID CC[C@@H](NC(=O)Cc1ccccc1C)c1c(C)noc1C 160398555 XRBYTAGTOSNRMX-OAHLLOKOSA-N 286.375 3.410 70 20 CGID CC[C@@H](C(=O)Nc1ccc(OC(C)(C)C)cc1)N(C)C 159444266 MEEROHNAKSBOIB-AWEZNQCLSA-N 278.396 3.143 70 20 CGID CCN(CC)C(=O)C[C@H](C)NCCc1cc(C)cc(C)c1 159503785 GAVWSIFNDHVNJQ-INIZCTEOSA-N 290.451 3.083 70 20 CGID Cc1nc([C@H](C)N[C@@H]2CCN3CCCC[C@@H]23)c(C)s1 217629855 DMJATZLQANXLHV-GDLCADMTSA-N 279.453 3.037 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cc(F)ccc1F 160068316 WPPCYSYMAWDNQY-RYUDHWBXSA-N 270.367 3.346 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C)nc1 161231794 CYSNLSVTLVSGKQ-UKRRQHHQSA-N 260.381 3.431 70 20 CGID Cc1cc(C)cc(C[C@H](C)NC(=O)c2ccc(N)cc2)c1 161346988 QTSYPENGMZVWFR-AWEZNQCLSA-N 282.387 3.247 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cn1 161369319 RRQGKBPLPKJAMI-LSDHHAIUSA-N 285.322 3.207 70 20 CGID Cc1ccc(C[C@@H](C)NC(=O)NC2(C)CCC2)s1 161420775 HBPCNSZZMBAZFB-SNVBAGLBSA-N 266.410 3.229 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)Cc1c[nH]c2cc(F)ccc12 161421315 JYPPJMUDACRUFX-PHIMTYICSA-N 274.339 3.249 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)C3[C@H]4CCC[C@@H]34)c2C)o1 161474370 ZJLSZIHIFOENQN-QYJAPNMZSA-N 285.347 3.271 70 20 CGID CCOc1cccc(C(=O)N(C)c2ccc3c(c2)OCO3)c1 160084848 ZXJJDFGSBJNQJF-UHFFFAOYSA-N 299.326 3.091 70 20 CGID O=C(C[C@@H]1CCc2ccccc21)NCC1(C2CC2)CC1 160177910 AXDBXZNQILOXQL-AWEZNQCLSA-N 269.388 3.413 70 20 CGID CCCc1nnc(NC(=O)c2ccc(Cl)nc2C)s1 160358524 AWXKHMCUPRNZBR-UHFFFAOYSA-N 296.783 3.100 70 20 CGID CC[C@H](C)OCC(=O)NCc1ccccc1OCC(C)C 160393468 JFNIWOZEZWUWLI-AWEZNQCLSA-N 293.407 3.153 70 20 CGID Cc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)s1 160508475 VMVTUJFFWHJHHJ-UHFFFAOYSA-N 275.329 3.062 70 20 CGID CS[C@H](C)CC(=O)N(C)CCCOc1ccccc1C 160566104 DNDPXKJIAGECGN-CQSZACIVSA-N 295.448 3.364 70 20 CGID Cc1noc(C)c1[C@H](C)NC(=O)C[C@@H](C)c1ccncc1 160595454 VGJCGJJQOWKIBK-MNOVXSKESA-N 287.363 3.057 70 20 CGID Cc1ccc(C)c([C@H]2CCCN2C(=O)CN(C)C(C)C)c1 160708029 VLNCECZCBDPQGM-QGZVFWFLSA-N 288.435 3.307 70 20 CGID C[C@H](c1ccc(Cl)cc1)N(C)C[C@H](O)C1CC1 160868149 PPMOFXBYUXIAKP-YGRLFVJLSA-N 253.773 3.104 70 20 CGID CC(C)Sc1ccccc1NC(=O)[C@H]1CCCN1C 160930839 WOMYAMGBGNZIIX-CYBMUJFWSA-N 278.421 3.220 70 20 CGID CCCCn1ncc(NC(=O)N2CCCCCC2)c1C 159637363 FQUBMCJEZQZBJR-UHFFFAOYSA-N 278.400 3.400 70 20 CGID Cc1ccsc1CCCC(=O)NCCCOCC1CC1 159847086 SJWPZXOYTOWMKL-UHFFFAOYSA-N 295.448 3.312 70 20 CGID CC(C)(C)c1nsc(NC[C@](C)(O)c2ccccc2)n1 159486650 TWPZBVJELXRBBY-HNNXBMFYSA-N 291.420 3.155 70 20 CGID c1ccc2oc(CN[C@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2c1 159491221 CXRWXOHYHUXGQJ-XIRDDKMYSA-N 283.371 3.480 70 20 CGID CCN(C(=O)[C@H]1CCCCO1)C12CC3CC(CC(C3)C1)C2 159696819 BJIQYQMZILMSBB-QFQXCOSMSA-N 291.435 3.373 70 20 CGID CCSc1nnc(-c2cccc(Cl)c2)n1C 159753636 ZXIKKQASGIYWDC-UHFFFAOYSA-N 253.758 3.248 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)Cc1ccc(OC)cc1 159396345 PUDGQIYJGWEUCA-HOCLYGCPSA-N 261.365 3.090 70 20 CGID Cc1nn(C)c(C)c1[C@@H](OC(=O)CC(C)C)C(F)(F)F 159981256 IGHNNWFGGZPXRQ-GFCCVEGCSA-N 292.301 3.230 70 20 CGID CCC[C@H](C(=O)N[C@@H](C)c1cc2ccccc2o1)N(C)C 161279442 LFKKIQLLMQCBNK-GXTWGEPZSA-N 288.391 3.340 70 20 CGID C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCC2(CCC2)C1 160426225 QHLRBVXUKAHQHY-CABCVRRESA-N 294.439 3.167 70 20 CGID CCN(C(=O)c1cccnc1O)[C@@H](C)c1ccc(F)cc1 160627825 SPVCXPNRCGTYMS-NSHDSACASA-N 288.322 3.150 70 20 CGID Cc1c(C(=O)NC[C@H]2CCC[C@@H](C)C2)cnn1CC(C)C 160896757 QXBOVYLPRCMPTG-HIFRSBDPSA-N 291.439 3.404 70 20 CGID Cc1conc1NC(=O)[C@H](C)Cc1ccccc1Cl 160949971 CKHRBCXJWGKJRS-SECBINFHSA-N 278.739 3.454 70 20 CGID CCC[C@@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 160987680 ADHGPSZDZTWJFU-GZMMTYOYSA-N 289.206 3.298 70 20 CGID COC(=O)c1ccc(NC(=O)c2cc(C)c(C)o2)cc1F 159385602 RKEAFOITRWSWOS-UHFFFAOYSA-N 291.278 3.074 70 20 CGID CCCn1nccc1CNCCCOC1CCCCC1 159989248 BLHFXXNLEPIHQN-UHFFFAOYSA-N 279.428 3.122 70 20 CGID CC(=O)Nc1ccccc1CNCC1(C(C)C)CC1 160541789 LOMXLAJGKJHBHL-UHFFFAOYSA-N 260.381 3.171 70 20 CGID O=S(=O)(Cl)c1cccc(-c2ccccc2)c1F 112734354 IQBITHQRXYPCIO-UHFFFAOYSA-N 270.712 3.420 70 20 CGID Nc1cccc(CNC2C3CC4CC(C3)CC2C4)c1 216715008 VNSSAJARHJPJLA-UHFFFAOYSA-N 256.393 3.183 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)Cc1c(C)noc1C 161027455 LXTOIONPKGHFMQ-DZGCQCFKSA-N 278.396 3.261 70 20 CGID CC[C@@H](S[C@@H](C)C(N)=O)c1ccc(F)cc1F 161368824 BTUZDTSKULQFHR-WRWORJQWSA-N 259.321 3.023 70 20 CGID CC(C)[C@H](NC(=O)NO[C@@H]1CCCCO1)c1ccccc1 161491000 ZWICXYQHOAVTHE-CABCVRRESA-N 292.379 3.141 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(OCC2CC2)cc1 160154143 MNRRKXYPNCMYEF-UHFFFAOYSA-N 285.387 3.395 70 20 CGID COCCCC(=O)NCCc1ccc(-c2ccccc2)cc1 160253005 IDNSWCAIPRALAA-UHFFFAOYSA-N 297.398 3.439 70 20 CGID Cn1ccnc1CN(C1CC1)[C@H]1CCc2ccccc21 160835216 BKZYLNRLKGGZMY-INIZCTEOSA-N 267.376 3.072 70 20 CGID Cc1cncc(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)c1 160878772 ZMVYZDFJYSJUQC-OAHLLOKOSA-N 288.391 3.002 70 20 CGID CCOCCCN[C@H](c1ccccc1)c1nccs1 159827407 IMBCPQDHQLERLZ-CQSZACIVSA-N 276.405 3.249 70 20 CGID O=C(CC1CCCC1)N[C@@H]1CCOC2(CCCC2)C1 159674543 SPUQRJNXWHWTDS-CQSZACIVSA-N 265.397 3.175 70 20 CGID C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@@H](C)O 159534896 WHCVEOSQIURADE-BDAKNGLRSA-N 262.180 3.367 70 20 CGID CN(Cc1ccc(Cl)cc1)C[C@H](O)Cc1ccccc1 218686554 FROUJDKLAZRKEU-QGZVFWFLSA-N 289.806 3.375 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2ccc(Cl)cc2N)O1 160779359 DPUMUTMIBDGZCO-JTQLQIEISA-N 283.755 3.037 70 20 CGID CC1(O)CCN(CCC23CC4CC(CC(C4)C2)C3)CC1 161223154 KAPXGKOPHOFOAA-UHFFFAOYSA-N 277.452 3.440 70 20 CGID CSc1ccc(NC2CCC(NC(C)=O)CC2)cc1 161082696 ZHWGWDDTJGOJFK-UHFFFAOYSA-N 278.421 3.268 70 20 CGID CCCC1(CNC(=O)CCn2cnc3ccccc32)CC1 160686114 NBQPCNQLNDNCPU-UHFFFAOYSA-N 285.391 3.123 70 20 CGID Cc1cc2cc([C@@H](C)NCC(=O)NC(C)C)oc2cc1C 160923578 ADPTWPNCMDMXAS-CYBMUJFWSA-N 288.391 3.225 70 20 CGID CCC(C)(CC)C(=O)N1CCO[C@H](Cc2ccccc2)C1 159447596 OKLHCGQWDKEWBL-MRXNPFEDSA-N 289.419 3.283 70 20 CGID CCc1nc2cc(NC(=O)[C@H]3CC3(C)C)ccc2o1 159462337 IFWHVJUVAZOWIC-SNVBAGLBSA-N 258.321 3.375 70 20 CGID CCOCc1cccc(NC(=O)NC2CC=CC2)c1 159534526 PMBFXLYUIGXTKR-UHFFFAOYSA-N 260.337 3.063 70 20 CGID CC(=O)c1csc(NC(=O)c2cccc(C)c2F)n1 159970239 JAPXXIZKRDOSNP-UHFFFAOYSA-N 278.308 3.046 70 20 CGID CCOC(CCN[C@@H](C)c1ccc(C)cc1)OCC 159924307 ILQDGERVUFKTMS-AWEZNQCLSA-N 265.397 3.435 70 20 CGID CCc1nc(CN[C@H](CC(C)C)c2ccccc2)n[nH]1 160274538 XDMITWWFHPABQF-CQSZACIVSA-N 272.396 3.244 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1ccc(Br)cc1 161396839 ARYPYXYJOQTDMN-AOOOYVTPSA-N 282.181 3.462 70 20 CGID CCCCCCOC[C@H](CC)CS(=O)(=O)Cl 114472817 FBWYHPWURKJEHW-NSHDSACASA-N 270.822 3.178 70 20 CGID Cc1ccc(OCCCCS(=O)(=O)Cl)cc1C 100495531 LMKYLQPUWDHYAV-UHFFFAOYSA-N 276.785 3.031 70 20 CGID CCCCNc1ccccc1C(=O)NCc1cccnc1 161346757 GLJZWEOXIHCUFI-UHFFFAOYSA-N 283.375 3.224 70 20 CGID CCOc1ccc(NC(=O)NC[C@@H](C)SC)c(C)c1 161361186 GMBQQCWVDDAESW-LLVKDONJSA-N 282.409 3.267 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)C[C@H]1C=CCC1 160102979 AFBPRJVYNKNPGV-WFASDCNBSA-N 271.360 3.155 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@@H]1CCCS1 160152715 RHXPZMVNWRENJJ-JQWIXIFHSA-N 267.419 3.137 70 20 CGID CCCN(CCN(CC)CC)C(=O)Nc1ccc(F)cc1 160535226 XZYSERVHECDZGF-UHFFFAOYSA-N 295.402 3.411 70 20 CGID CC1(C)C[C@H](Nc2ncccc2C(F)(F)F)CCO1 160654421 WNOMCWBRVOVGJD-SECBINFHSA-N 274.286 3.470 70 20 CGID COc1cc(C(=O)NC[C@@H]2CC=CCC2)ccc1Cl 160701161 HXRVUQOXMUBAIW-LLVKDONJSA-N 279.767 3.435 70 20 CGID CCCC(O)(CCC)CC(=O)NCC1(CCC)CC1 160810028 WMBCPBHXYLUNNY-UHFFFAOYSA-N 269.429 3.404 70 20 CGID O=c1c2ccoc2ccn1Cc1noc(C2CCCCC2)n1 159803200 MOWMVGKASRDDGF-UHFFFAOYSA-N 299.330 3.074 70 20 CGID COc1ccccc1C[C@@H](NCCC(C)(C)O)C(C)C 159738941 DPKMJKHFYFVNKI-OAHLLOKOSA-N 279.424 3.013 70 20 CGID c1ccc([C@H](N[C@@H]2CCSC2)c2ccccn2)cc1 218593187 KXSPKDPQBCQSNL-ZBFHGGJFSA-N 270.401 3.266 70 20 CGID CC[C@H](C)[C@H](NCc1cc(F)cc(Cl)c1)C(=O)OC 160873387 CPGAZCDVDHRYEC-ZANVPECISA-N 287.762 3.156 70 20 CGID COc1ccc([C@@H](C)N[C@H]2CCC[C@H](N(C)C)C2)cc1F 161040005 AKTPRSRBKBCNBO-SNPRPXQTSA-N 294.414 3.358 70 20 CGID CCC[C@H](NC(=O)[C@@H]1C[C@@]1(C)CC)C(=O)OC(C)(C)C 161470438 RWLZDSSUTKQQGL-MQIPJXDCSA-N 283.412 3.049 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1occc1C 160231754 VGCRBSDNQPNKIC-ZDUSSCGKSA-N 271.316 3.014 70 20 CGID COc1ccccc1CN(C)Cc1cnc2cc(C)ccn12 160418059 NLCMLHDXTUZLFP-UHFFFAOYSA-N 295.386 3.283 70 20 CGID CCCC1(CNC(=O)[C@@](C)(OC)c2ccccc2)CC1 160617635 GXRJZFSEKGUGTQ-INIZCTEOSA-N 275.392 3.245 70 20 CGID CCCCn1ncc(NC(=O)N[C@H](C)C(C)C)c1C 159639297 OLZODMXPQVVAMT-LLVKDONJSA-N 266.389 3.158 70 20 CGID O=C(Nc1ccc(-c2nccs2)cc1)[C@H]1CCCCO1 159981008 BRSDZUIAKAYSCH-CYBMUJFWSA-N 288.372 3.318 70 20 CGID Cc1[nH]ncc1CCCNc1cc(Cl)nc(C2CC2)n1 217964818 AMFFZJXZMYDFKO-UHFFFAOYSA-N 291.786 3.084 70 20 CGID CCCn1nccc1CNc1cccc(COC)c1 160005010 LJAZFRQOWHPAGU-UHFFFAOYSA-N 259.353 3.052 70 20 CGID CC[C@H](NCCCc1cnn(C)c1)c1ccc(F)cc1 160868331 HGMKREJOFSJIFA-INIZCTEOSA-N 275.371 3.233 70 20 CGID O=C(CC1CCCCCC1)N1CCCC[C@H]1CCO 161013582 IMSZZVFXHAWPPR-HNNXBMFYSA-N 267.413 3.110 70 20 CGID CC[C@@H]1CCCN(C(=O)NCC2(CCOC)CC2)CC1 161129324 WNBHPCLXKQWFBE-CQSZACIVSA-N 282.428 3.025 70 20 CGID COC(CN1CCCC[C@@H]1c1ccc(C)cc1)OC 161234600 YGPWPIVKVVBLCB-OAHLLOKOSA-N 263.381 3.141 70 20 CGID Cc1ccc(NC(=O)[C@H](C)N)cc1OCC1CCCCC1 161378893 UOVKXZICMOYLKN-ZDUSSCGKSA-N 290.407 3.240 70 20 CGID CC[C@@H](CSC)N(C)Cc1nc2ccccc2[nH]1 161400706 LRGQRSBVLZNYMK-NSHDSACASA-N 263.410 3.136 70 20 CGID CN1CCC(N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)CC1 161475255 GPCWERTZWQGLLW-OAHLLOKOSA-N 292.398 3.112 70 20 CGID Cc1ncsc1C(=O)N[C@H]1CCCc2sccc21 160024424 AAFDQPDHBYKBFX-JTQLQIEISA-N 278.402 3.320 70 20 CGID CC[C@H](SC)C(=O)O[C@@H](c1ccccn1)C(F)(F)F 160106074 SWNFVGRHKXGHAM-UWVGGRQHSA-N 293.310 3.370 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)NC[C@@H](C)c1c(C)noc1C 160231424 HKLGIRBYPDSSTJ-HONMWMINSA-N 293.411 3.273 70 20 CGID Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(C(C)C)cc1)CC2 160302178 MGQWKLCXWUSOBZ-CXAGYDPISA-N 298.434 3.376 70 20 CGID C[C@H](CC(=O)N1CCCC(C)(C)C1)c1ccncc1 160341821 GGECCEWLOZSSHG-CYBMUJFWSA-N 260.381 3.224 70 20 CGID COCc1cccc(NC(=O)N[C@H](C)C2CCC2)c1 160578981 UXYHTZPHOYEKBU-LLVKDONJSA-N 262.353 3.143 70 20 CGID CCOCCC1(C(=O)NCc2ccccc2F)CCC1 160591540 BRSXBMNYDIPJHC-UHFFFAOYSA-N 279.355 3.039 70 20 CGID CC(C)(C)c1ccc(C(=O)NOCc2cccnc2)cc1 160723368 GQQXYPFAMIACKI-UHFFFAOYSA-N 284.359 3.241 70 20 CGID OCC[C@@H](N[C@H]1CCc2ccccc2C1)c1ccccc1 160981628 SVJDKUTVUUXRJH-RBUKOAKNSA-N 281.399 3.257 70 20 CGID Cc1ccccc1[C@H](C)NCC1(C(=O)N(C)C)CCCC1 159624268 RDGATUGYZXVSLU-HNNXBMFYSA-N 288.435 3.294 70 20 CGID Cc1ccc(F)c(NC(=O)N(C)[C@H]2CCSC2)c1 159476855 HFUOZDJSUDSKLQ-JTQLQIEISA-N 268.357 3.103 70 20 CGID CC[C@H](NC(=O)Nc1cc(C)ccc1F)[C@@H]1CCCO1 159477926 QPZVCJXQKGTGCX-JSGCOSHPSA-N 280.343 3.213 70 20 CGID C[C@@H](NCCO)c1ccc2ccccc2c1OC(F)F 159678915 MMGJIRXPHXPFSC-SNVBAGLBSA-N 281.302 3.084 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)C2CCOCC2)C1 159503257 VUDUFDUFJLGIJX-LBPRGKRZSA-N 291.416 3.188 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1cccc(F)c1F 159941549 KHUCJGDOLFCICV-NSHDSACASA-N 295.329 3.186 70 20 CGID c1cc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2cc[nH]c2c1 159571892 WVOHFQQIMWZUEM-XIRDDKMYSA-N 282.387 3.215 70 20 CGID COC(=O)c1occc1CN1c2ccccc2CC[C@H]1C 216892752 WVUZQACINWOQDV-GFCCVEGCSA-N 285.343 3.408 70 20 CGID C[C@H](C(=O)N1CCCC[C@H]1C)c1c(F)cccc1F 161149139 BXCXINRIBWGVLP-MNOVXSKESA-N 267.319 3.469 70 20 CGID O=C(CC[C@@H]1CCCO1)N[C@@H]1CCCc2sccc21 160138981 RKJMZYZETKVFEV-WCQYABFASA-N 279.405 3.201 70 20 CGID O=C(CC1CC1)O[C@H](c1ccccn1)C(F)(F)F 160400160 GNWCUVFAGPBABN-LLVKDONJSA-N 259.227 3.028 70 20 CGID Cc1csc(CCCCNC(=O)NC2(C)CCC2)n1 160591510 JJZPAKDUOXZURI-UHFFFAOYSA-N 281.425 3.016 70 20 CGID CC[C@H](NCCC(=O)OC(C)C)c1ccc(F)cc1 160693536 KSUDAFLEFYGDOX-AWEZNQCLSA-N 267.344 3.208 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccsc1 160869540 DCIQMDJNRQWSJZ-VIFPVBQESA-N 279.386 3.201 70 20 CGID CCCCN1CCC(NC(=O)[C@H](C)c2cccs2)CC1 159628785 OANLQGVWADASNZ-CYBMUJFWSA-N 294.464 3.232 70 20 CGID COc1ccc(N(C)C(=O)CCC(C)C)cc1F 159681578 LPNPLTLHUMMJFE-UHFFFAOYSA-N 253.317 3.233 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1cccnc1 159748450 IUNXMDXOAFPCRI-IACUBPJLSA-N 286.400 3.432 70 20 CGID CC[C@@H]1CCN(C(=O)Nc2ccnc(C)c2Cl)C1 159755854 BMQGPZZECFFFMY-SNVBAGLBSA-N 267.760 3.307 70 20 CGID CC[C@H](COC)NC(=O)NC1(c2ccccc2)CCCC1 159953742 RYAFKPRUWLJEMM-OAHLLOKOSA-N 290.407 3.180 70 20 CGID CCC(=CC(=O)N[C@@H]1CCOC2(CCCC2)C1)CC 159372066 JJTOVMDDWBKZRS-CQSZACIVSA-N 265.397 3.341 70 20 CGID Cc1nccc(NC(=O)N[C@H](C)c2cccnc2)c1Cl 159568286 RCENMGLTBTVGJZ-SECBINFHSA-N 290.754 3.321 70 20 CGID CCc1ncnc(N[C@@H](C)CCc2ccco2)c1F 217959131 VZTZTHJDNXEFCZ-JTQLQIEISA-N 263.316 3.204 70 20 CGID CCC[C@H](CCO)CNC(=O)c1cc(C)cc(Cl)c1 159834506 DZRSZQPBPPINNV-GFCCVEGCSA-N 283.799 3.177 70 20 CGID CCCc1sc(C(=O)N[C@H]2CCC[C@H](N)C2)cc1CC 161145046 KEXNEZSAUUMOTL-STQMWFEESA-N 294.464 3.263 70 20 CGID CCC(CC)(CN)NC(=O)c1cc2ccc(F)cc2s1 161204594 UVBZPCJWBWQYRB-UHFFFAOYSA-N 294.395 3.288 70 20 CGID c1ccc2c(c1)CC[C@@H]2NCCc1ccc2c(c1)OCO2 161119738 CBYCWMVOVWGACX-INIZCTEOSA-N 281.355 3.235 70 20 CGID C[C@H](NCCc1ccc2c(c1)OCO2)C1CCCC1 161146953 IRNBQRHDCQRUHJ-LBPRGKRZSA-N 261.365 3.126 70 20 CGID CCOCCC1(C(=O)Nc2cccc(OC)c2)CCC1 161177982 XQIRGLLKOHSAGV-UHFFFAOYSA-N 277.364 3.231 70 20 CGID COc1ccc(CC[C@H](C)NC(=O)C[C@H](C)SC)cc1 161389874 ZXFXFRMOVZKJTM-STQMWFEESA-N 295.448 3.274 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)C3[C@H]4CCC[C@H]34)c2C)o1 161474261 ZJLSZIHIFOENQN-QWRGUYRKSA-N 285.347 3.271 70 20 CGID C[C@H](NCCOc1ccc(F)cc1F)C1(C)CC1 160090037 MATVRJGBSIBKQI-JTQLQIEISA-N 255.308 3.122 70 20 CGID CC[C@H](NC(=O)[C@H]1CC=CCC1)c1c(C)noc1C 160103999 LULORQCPYARZHJ-STQMWFEESA-N 262.353 3.215 70 20 CGID CC(C)C[C@@H](C)NC(=O)N1CCc2cccc(F)c2C1 160202941 AKUDQQDBYINXLQ-GFCCVEGCSA-N 278.371 3.328 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)CCOc1ccc(F)cc1 160233954 GUQKDJPFDZTQMM-HOCLYGCPSA-N 279.355 3.099 70 20 CGID CC(=O)Nc1cc(NC(=O)N[C@H](C)C2CCC2)ccc1F 160314694 YZBAXHVSCWALBE-SECBINFHSA-N 293.342 3.094 70 20 CGID CC[C@H](CN[C@H](CC)[C@@H]1CCOC1)Oc1ccccc1F 160331137 XHDPNUORHSDRME-IIAWOOMASA-N 295.398 3.388 70 20 CGID CN(Cc1cccn1C)C(=O)C/C=C/c1ccccc1F 160417838 LQWGNMYBIFWUPP-VMPITWQZSA-N 286.350 3.226 70 20 CGID COCCCCCNC(=O)NCC1CCC(C)(C)CC1 160777219 GSCJRUFUFMPCKM-UHFFFAOYSA-N 284.444 3.319 70 20 CGID CC[C@H](C)OCC(=O)N[C@H]1CCC(C)(C)C[C@@H]1C 160810495 RHOSLUKRDCWYGS-AVGNSLFASA-N 255.402 3.133 70 20 CGID Cc1ccc(NC(=O)N[C@@H](C)C2CCC2)c(F)c1 159440148 PNPOOLANUHICHW-JTQLQIEISA-N 250.317 3.444 70 20 CGID CCCC1(CNC(=O)NCc2ccc(O)cc2)CCC1 159896242 KGOSHSHLWRMSIS-UHFFFAOYSA-N 276.380 3.162 70 20 CGID COC(=O)c1ccc(N[C@@H]2CCC[C@@H](SC)C2)nc1C 218023329 OSQJDRLCTHXSIF-VXGBXAGGSA-N 294.420 3.263 70 20 CGID CN(Cc1cccc(C(F)(F)F)c1)C[C@H]1CCC[C@@H]1O 159746489 HGGDLFJNFZZSSF-OCCSQVGLSA-N 287.325 3.298 70 20 CGID CCS[C@H]1CC[C@@H](N(C)C(=O)NC2CCCC2)C1 161434818 QUGKYBCQPZZCQD-OLZOCXBDSA-N 270.442 3.245 70 20 CGID Cc1ccc(-c2cnn(CC3CCNCC3)c2)cc1C 217237628 WTLDXWHDEUOTFL-UHFFFAOYSA-N 269.392 3.167 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)c2ccoc2C)o1 161246818 HZTPBKHHZBYGLC-CQSZACIVSA-N 289.331 3.305 70 20 CGID CC[C@H]1CCCC[C@@H]1NC(=O)Cc1c(C)noc1Cl 160102753 FFCKKOKJFRFYLT-JQWIXIFHSA-N 284.787 3.264 70 20 CGID CCc1nc(CN[C@H](C)c2cccc3ccccc23)n[nH]1 160272722 XWXGZKUGVMCHAH-GFCCVEGCSA-N 280.375 3.371 70 20 CGID O=C(N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)c1ccc(O)c(Cl)c1 160616370 PKFMUGADDIZREN-UHOFOFEASA-N 299.757 3.114 70 20 CGID Cc1cccc([C@H](C)NC(=O)C2(N)CCCCC2)c1C 160835961 CLGRFSIKAONUIA-AWEZNQCLSA-N 274.408 3.142 70 20 CGID CC(C)c1ccc(C(=O)NCCCOc2ccccc2)cn1 160837375 BSGIVEUJDBVMIT-UHFFFAOYSA-N 298.386 3.404 70 20 CGID CC1(C)CCC(CNC(=O)NCCc2cccnc2)CC1 159507948 RXLSANZNCOZLSD-UHFFFAOYSA-N 289.423 3.140 70 20 CGID Cc1cc(NC(=O)[C@@H](C)Cc2ccccc2F)ccn1 159925543 IGQDTQRDUSTENK-NSHDSACASA-N 272.323 3.346 70 20 CGID CC(C)c1nn(C)c(Cl)c1C(=O)OCc1cncs1 159566985 FRRKGAJKJHJFBQ-UHFFFAOYSA-N 299.783 3.010 70 20 CGID C[C@H](CNCc1cccc2c1NCCC2)N1CCCCC1 159386605 CYXXQZHOWCVOLN-OAHLLOKOSA-N 287.451 3.009 70 20 CGID CC[C@@H](C)[C@@H](O)CNC(=O)[C@@H](C)Cc1ccccc1Cl 159396417 LONURADEVUUKEF-XUJVJEKNSA-N 297.826 3.042 70 20 CGID CCCCC1CCC(C(=O)N(C)[C@@H](CN)C2CC2)CC1 159784554 KELOIDBFZSGMCA-BCLQGDPASA-N 280.456 3.179 70 20 CGID CC1CCN(C(=O)N2CCC[C@H]3CCCC[C@@H]32)CC1 160373456 UMCMLVCOJAZTOX-CABCVRRESA-N 264.413 3.493 70 20 CGID CC(C)(C)C[C@H](CO)Nc1cccc(C(F)(F)F)n1 161425530 CSFOSOXQFLCAJG-SECBINFHSA-N 276.302 3.309 70 20 CGID CCCCOCCNc1ccncc1Br 159826142 VYQNQIMFIFBWSY-UHFFFAOYSA-N 273.174 3.073 70 20 CGID Cc1cccc2c(CC(=O)NCC3(C4CC4)CC3)c[nH]c12 160019925 ULGVGCGHTKXALO-UHFFFAOYSA-N 282.387 3.325 70 20 CGID Cc1ccc(CNc2ccc(C(F)(F)F)nc2)nc1 160068246 HYPWLELCPPNZLS-UHFFFAOYSA-N 267.254 3.416 70 20 CGID CC(C)=C[C@@H]1[C@H](C(=O)N(C)Cc2cccn2C)C1(C)C 160454403 MZAHVYGMNDFBBU-HUUCEWRRSA-N 274.408 3.222 70 20 CGID CCC[C@@H](NCc1n[nH]c(CC)n1)c1ccc(F)cc1F 160504226 QPFRYFOXEMGHFR-CYBMUJFWSA-N 294.349 3.276 70 20 CGID Cc1cnc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)nc1C 160615768 UBUHNBUQMNWYGI-HZPDHXFCSA-N 283.375 3.426 70 20 CGID Cc1ccc(F)cc1NC(=O)N[C@@H]1CCOC(C)(C)C1 160837288 QLJVKXSSLDAGBW-GFCCVEGCSA-N 280.343 3.213 70 20 CGID CCCCCC[C@H](C)NC(=O)NOCc1cccnc1 160988232 GLYIQGXDDJSTQT-ZDUSSCGKSA-N 279.384 3.171 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cccc2c1CCC2 159801611 GGDQXULCQOZRED-UHFFFAOYSA-N 255.361 3.095 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)C2CCOCC2)C1 159503102 VUDUFDUFJLGIJX-GFCCVEGCSA-N 291.416 3.188 70 20 CGID COc1ccccc1C[C@H](NCCC(C)(C)O)C(C)C 159739064 DPKMJKHFYFVNKI-HNNXBMFYSA-N 279.424 3.013 70 20 CGID C[C@@H](NC[C@@](C)(O)c1ccsc1)c1cccnc1Cl 159958062 YXWJXRMXHHIWQS-QMTHXVAHSA-N 296.823 3.355 70 20 CGID Cc1c(C(=O)OCCCC2CCCCC2)cnn1C 218546558 LTIVSTPDANSSQU-UHFFFAOYSA-N 264.369 3.246 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)C(=O)NC(C)(C)CC 160587660 JIYAGYNTDVSSEU-STQMWFEESA-N 256.434 3.048 70 20 CGID C[C@@H]1CN(Cc2csc(C3CC3)n2)CC(C)(C)O1 161467905 MJSZQTBQUDTWNU-SNVBAGLBSA-N 266.410 3.020 70 20 CGID Cc1nc(CC(C)C)c(C(=O)NC2CC=CC2)s1 161046338 BDKAJRULKABNHH-UHFFFAOYSA-N 264.394 3.098 70 20 CGID Cc1ccc(CNc2cc(C(N)=O)ccc2C)cc1F 160031910 MTEPTLPMLOALSD-UHFFFAOYSA-N 272.323 3.154 70 20 CGID Cc1cc(NC[C@](C)(O)c2ccccc2Cl)nc(C)n1 160149836 VVYZFMQAEGRTCA-HNNXBMFYSA-N 291.782 3.066 70 20 CGID C[C@@H](NCCOc1cccc2ccccc12)c1cnccn1 160812588 LYSOFHUJOHOWES-CQSZACIVSA-N 293.370 3.359 70 20 CGID CCCN(C)C[C@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160817414 DIMDMRUWEPYQRJ-OAHLLOKOSA-N 294.483 3.393 70 20 CGID CCNC(=O)CCC(=O)Nc1ccccc1SC(C)C 160909948 HBDRZUDXPODGJG-UHFFFAOYSA-N 294.420 3.042 70 20 CGID CCn1nccc1CNCc1ccccc1OC(F)(F)F 159914925 SBNLKOYHQJEVNQ-UHFFFAOYSA-N 299.296 3.091 70 20 CGID CC(C)Oc1ncccc1CNc1cccc(F)n1 218121169 LQZBIEGSQATTGL-UHFFFAOYSA-N 261.300 3.015 70 20 CGID O=C(NCCC12CC3CC(CC(C3)C1)C2)[C@@H]1CCCOC1 216721461 RURDYHNABWSCBT-QFQXCOSMSA-N 291.435 3.136 70 20 CGID CC[C@H](C)OCC(=O)Nc1ccc(Cl)c(NC(C)=O)c1 161278232 DRXRHIFIVGIABZ-VIFPVBQESA-N 298.770 3.052 70 20 CGID C[C@H]1C[C@@H](NCC2(c3ccc(F)cc3)CC2)[C@H](C)CN1C 161359785 UXPCPICRXBWRLF-JKIFEVAISA-N 290.426 3.176 70 20 CGID C[C@H](Cc1ccc(Cl)cc1)C(=O)NC1(C)CCOCC1 161510678 VLHBIVSIDJKXDW-GFCCVEGCSA-N 295.810 3.204 70 20 CGID CC(C)n1cccc1C(=O)Nc1ccc2nccnc2c1 160003943 ZKMLGTJTMCIJRL-UHFFFAOYSA-N 280.331 3.265 70 20 CGID Cc1ccc(C(N)=O)cc1NCc1ccc([C@H]2C[C@@H]2C)o1 160025396 SKVNMWUWOGQDLS-FZMZJTMJSA-N 284.359 3.422 70 20 CGID CC(C)n1ccnc1CN1C[C@H](C)O[C@@H](c2ccccc2)C1 160851127 JPIHDFLJCVFRMT-DOTOQJQBSA-N 299.418 3.426 70 20 CGID CN(CCc1cccs1)Cc1cnc2ccccn12 160852178 DWDCZXSZBQOYGF-UHFFFAOYSA-N 271.389 3.070 70 20 CGID CCCCN(Cc1nncn1C)[C@@H](C)c1ccccc1 160871491 FCVYZLSVIHRDRX-AWEZNQCLSA-N 272.396 3.178 70 20 CGID C/C=C(\C=C\C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2)CC 159701472 SXKXMYOSOJXTRM-LLQYDTPKSA-N 298.386 3.166 70 20 CGID CCCCn1ncc(C(=O)NCc2ccccc2F)c1C 159772218 RMHVMPKOXMRGLN-UHFFFAOYSA-N 289.354 3.061 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccccc1F 217679392 NBWGACAECLZZGL-MAZHCROVSA-N 262.372 3.103 70 20 CGID COc1cc(C)ccc1[C@H](C)N[C@@H]1CCN2CCCC[C@@H]12 218130104 JUXKBJODIHYYCZ-UAGQMJEPSA-N 288.435 3.281 70 20 CGID CC[C@@H](C)[C@@H](C)NC(=O)NCCc1ccc(C)cc1 217224314 NCVLYTCVPISPHG-ZIAGYGMSSA-N 262.397 3.271 70 20 CGID CCCC[C@@H](COC)NCc1ccc(OC(C)C)nc1 160079922 JFSOFDSDZKXYNV-HNNXBMFYSA-N 280.412 3.164 70 20 CGID C[C@@H]1CC(C(=O)N[C@@H]2CCCc3sccc32)C[C@@H](C)O1 160128008 ZVYDQMDUPFGDJF-JTNHKYCSSA-N 293.432 3.445 70 20 CGID CC[C@@H](NC(=O)c1cc(C)c(C)o1)c1c(C)noc1C 160213517 HZXMDVXGEFRJFQ-GFCCVEGCSA-N 276.336 3.382 70 20 CGID CCc1cc(O)nc(CN[C@H](C)c2ccccc2Cl)n1 160539286 QHQNZXGFWYRHKA-SNVBAGLBSA-N 291.782 3.249 70 20 CGID C[C@H]1CCC[C@H](OCCCCCC(=O)N(C)C)C1 160636754 TYAMZSQQPCINNP-KBPBESRZSA-N 255.402 3.230 70 20 CGID Cc1cccc([C@H]2CCCN2C(=O)[C@H]2CC[C@H](N)C2)c1C 160721295 ZKQASOMWHLUKJW-YQQAZPJKSA-N 286.419 3.094 70 20 CGID Fc1ccc(F)c(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159606644 HOAVZTVNKSFAQD-SNPRPXQTSA-N 279.330 3.012 70 20 CGID CCC(CC)NC(=O)[C@@H](C)N[C@H](C)c1cccc(F)c1F 159424866 SRMHIJJZWCQBOE-GHMZBOCLSA-N 298.377 3.309 70 20 CGID CC1(C)CCCN(CC2CCN(C(=O)C(C)(C)C)CC2)C1 159654860 OQNYDHUCIGCQDN-UHFFFAOYSA-N 294.483 3.393 70 20 CGID CCC(C)(CC)C(=O)Nc1ccc(C(=O)NC)cc1Cl 159502223 UXCHERHYMLQRNY-UHFFFAOYSA-N 296.798 3.464 70 20 CGID CC(C)CC1(CNC(=O)N(C)CC2CCOCC2)CCC1 159917832 WZFLKOWJGZFHMF-UHFFFAOYSA-N 296.455 3.271 70 20 CGID Fc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1F 159514389 JJMIWIWAGURYAO-DFBGVHRSSA-N 279.330 3.012 70 20 CGID Cc1ccc(CCNC(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 217225160 AQUHKKHLNNDQRN-GASCZTMLSA-N 274.408 3.225 70 20 CGID COc1ccccc1CCNc1ncnc2c1CCCC2 217799664 KJLISIZNMFDQOH-UHFFFAOYSA-N 283.375 3.019 70 20 CGID CC[C@H](CO[C@@H](C)CC(C)C)CS(=O)(=O)Cl 114472721 NNUGQIQICIJMON-WDEREUQCSA-N 270.822 3.032 70 20 CGID CCOc1cccc(C(=O)NCC2(C3CC3)CC2)c1 160198689 GCOHWTVEZOSHLX-UHFFFAOYSA-N 259.349 3.005 70 20 CGID CC[C@H](S[C@@H]1CCN(C)C1=O)c1ccc(F)cc1F 161374483 PGZRYKZFQOGJSZ-QWHCGFSZSA-N 285.359 3.380 70 20 CGID CC(C)(CCO)NC(=O)c1ccc(-c2ccccc2)cc1 161509122 OTQYYUDVWCUYIR-UHFFFAOYSA-N 283.371 3.244 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1 160133226 DCHQENAWTSJNPV-FUHWJXTLSA-N 288.435 3.013 70 20 CGID Cc1nc(CC(=O)Nc2cc(F)cc(F)c2)c(C)s1 160253522 WJMYRGQQVKNUHM-UHFFFAOYSA-N 282.315 3.219 70 20 CGID CC(C)c1ccc(C(=O)N[C@@H](C)CNc2ccccc2)cn1 160395868 IXSLFXJAVRVSCH-AWEZNQCLSA-N 297.402 3.435 70 20 CGID CC[C@H](NC(=O)[C@@H]1CCCCO1)c1ccc(Cl)cc1 160502501 MBMZUIFERIJSKD-KBPBESRZSA-N 281.783 3.476 70 20 CGID CCO[C@@H](C)C(=O)N1C[C@H](C)CSc2ccccc21 159520453 MFZMCQRJZJUIDI-RYUDHWBXSA-N 279.405 3.186 70 20 CGID CCOc1cccc(CN[C@@H](CC)c2cnn(C)c2)c1 159382084 GKPCCUCOWMAJLL-INIZCTEOSA-N 273.380 3.060 70 20 CGID CC[C@H](c1ccncc1)N(C)C(=O)OC(C)(C)C 159729256 MPAJEYICBRTOKA-GFCCVEGCSA-N 250.342 3.400 70 20 CGID CCOc1ccc(CNC(=O)Nc2cccc(C)n2)cc1 217300906 BREODLNDDVWMFS-UHFFFAOYSA-N 285.347 3.110 70 20 CGID C[C@@H](NCc1ccc(Br)cn1)C1CCC1 160178280 GTNQHEQNERVARX-SECBINFHSA-N 269.186 3.122 70 20 CGID C/C=C/C=C/C(=O)Nc1ccccc1-c1nc(CC)n[nH]1 161239509 VOIWCGJQZPILBJ-JFDBYLHYSA-N 282.347 3.105 70 20 CGID C[C@@H](N[C@H]1CCOc2c(Cl)cccc21)c1cnccn1 161279720 YCLLNLXLOUJZHN-MFKMUULPSA-N 289.766 3.304 70 20 CGID CCO[C@H](C)c1nccn1Cc1cc(F)ccc1F 161452941 PTXAYBRBSUQDPI-SNVBAGLBSA-N 266.291 3.307 70 20 CGID Cc1cccc([C@H](C)NC(=O)OCC(F)(F)F)c1 160324462 OMMNHJPTGARGHK-VIFPVBQESA-N 261.243 3.345 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CC[C@H](C)C[C@H]1C 160588000 COWFBQYBNJKVTN-NWDGAFQWSA-N 299.374 3.306 70 20 CGID CCc1nc2c(s1)[C@@H](N(C)C(=O)NCC1CC1)CCC2 160886411 DCIUDWXZDBYHLP-LBPRGKRZSA-N 293.436 3.134 70 20 CGID O=C(Nc1c(F)cccc1F)N[C@@H]1CCO[C@@H](C2CC2)C1 160999935 ZEOHALRRNQWXSC-ZWNOBZJWSA-N 296.317 3.044 70 20 CGID CCc1nn(C)c(Cl)c1C(=O)Nc1cscc1C 159554931 XEVJEGJXYKMBMR-UHFFFAOYSA-N 283.784 3.258 70 20 CGID COc1cc(C(=O)Nc2cc(C)ccc2O)ccc1F 159653956 ZMLUOUIUDZBPAA-UHFFFAOYSA-N 275.279 3.101 70 20 CGID Cc1cccn2cc(CNC(=O)CCC(C)(C)C)nc12 159472353 HYHULPMQUCVSFS-UHFFFAOYSA-N 273.380 3.085 70 20 CGID CCCN(CCC)C(=O)CCC(=O)N[C@H]1CCC[C@@H]1CC 159713376 GDQMIDVYPZPCEO-GJZGRUSLSA-N 296.455 3.110 70 20 CGID CC[C@@H](C)C(=O)O[C@@H](c1ccccn1)C(F)(F)F 159936656 SJHNCOFXMATZFJ-SCZZXKLOSA-N 261.243 3.274 70 20 CGID COc1cccc2cc(C(=O)NCC3(C4CC4)CC3)oc12 159747475 LOAANKVFHNLTFB-UHFFFAOYSA-N 285.343 3.361 70 20 CGID CO[C@@]1(C)C[C@H](N(C)C(=O)c2cc(C(C)C)on2)C1(C)C 159748132 KZDUMBHLSJECLB-BBRMVZONSA-N 294.395 3.074 70 20 CGID CCC(C)(CC)C(=O)NC[C@@H](C)c1c(C)noc1C 159361811 WDCVGPYTWBKFPM-SNVBAGLBSA-N 266.385 3.337 70 20 CGID CCN(C(=O)c1cccc(-c2ncn[nH]2)c1)C1CCCCC1 159363172 XSWWEORPFUKYAD-UHFFFAOYSA-N 298.390 3.267 70 20 CGID Cc1cccc2sc(NC(=O)[C@@H]3CCCCO3)nc12 159762599 HLMWXCXBZKDMCA-JTQLQIEISA-N 276.361 3.112 70 20 CGID Cc1ccc(NC(=O)NCc2ccc(CO)cc2)cc1C 217310775 UQFSGUHFWGKWAC-UHFFFAOYSA-N 284.359 3.117 70 20 CGID C[C@H](NC(=O)c1cc(F)cc2cccnc12)C1CCC1 161422713 PJFHMCLQZBKGHM-JTQLQIEISA-N 272.323 3.292 70 20 CGID C[C@@H](NC(=O)c1cc(F)cc2cccnc12)C1CCC1 161422829 PJFHMCLQZBKGHM-SNVBAGLBSA-N 272.323 3.292 70 20 CGID Cc1nc2ccccn2c1CN(C(C)C)C1CCC1 160566940 GTMVVCQLQUNMLT-UHFFFAOYSA-N 257.381 3.406 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(Br)cn1 159878255 FSCLVZLNEIKKDG-JOYOIKCWSA-N 283.169 3.219 70 20 CGID CCCNC(=O)c1cc(C(C)C)n(-c2ccccc2)n1 159591865 CSPHARMQARWNFB-UHFFFAOYSA-N 271.364 3.136 70 20 CGID O=C(CNc1ccccc1)N[C@H]1C[C@@H]1C1CCCCC1 161065779 KWPAXILKCWTPSX-CVEARBPZSA-N 272.392 3.184 70 20 CGID CN(C)[C@@H]1CCC[C@@H](N[C@@H]2CCc3cc(F)ccc32)C1 161003109 VXGODTAGULUNAT-BFYDXBDKSA-N 276.399 3.275 70 20 CGID COc1ccccc1[C@H](C)N[C@@H]1CCC[C@H](N(C)C)C1 161055122 ARSNRRJLBKMKHQ-ZNMIVQPWSA-N 276.424 3.219 70 20 CGID CC(C)[C@H](Sc1ccncc1)C(=O)NC(C)(C)C 159900288 PKJPKUZLCUNUGD-LBPRGKRZSA-N 266.410 3.113 70 20 CGID Cc1cc(C)cc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1 161010301 IDLRQBPKGWRZHC-HOCLYGCPSA-N 288.391 3.383 70 20 CGID CCc1ccc(CC(=O)NC[C@H]2Cc3ccccc32)cc1 161046197 BZUQSIUVCYEYAW-QGZVFWFLSA-N 279.383 3.248 70 20 CGID CCc1cc(Oc2ccc(F)nc2)nc(-c2ccncc2)n1 161246665 MMJVKIYAPOUICE-UHFFFAOYSA-N 296.305 3.427 70 20 CGID Cc1nc(SCc2ccnn2C)n(CC(C)C)c1C 161275924 ANJLBNLFDHKPOZ-UHFFFAOYSA-N 278.425 3.182 70 20 CGID CCO[C@@H]1C[C@@H](N[C@@H](C)c2cnn(C)c2)C1(CC)CC 161302332 RKPDDOUQKJGONY-NWANDNLSSA-N 279.428 3.055 70 20 CGID CCCn1nccc1CNc1ccccc1-n1cccn1 160037118 UABKZDVBYOTPRQ-UHFFFAOYSA-N 281.363 3.091 70 20 CGID COC(=O)c1ccc(F)c(NC(=O)N[C@H](C)CC(C)C)c1 160106371 WQJQQHSGOSTUPK-SNVBAGLBSA-N 296.342 3.168 70 20 CGID O=C(N[C@H]1[C@@H]2c3ccccc3C[C@H]21)c1ccc(O)c(Cl)c1 160616123 PKFMUGADDIZREN-DAXOMENPSA-N 299.757 3.114 70 20 CGID C[C@H]1C[C@H](N(C)C(=O)C2CCC(C)(C)CC2)CCN1C 160658374 MUSNNEZPNJRIOZ-DZGCQCFKSA-N 280.456 3.144 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)C[C@H](C)C1CCCCC1 160677632 ZGUHUCZJTVLPIH-QWHCGFSZSA-N 283.412 3.051 70 20 CGID CC(C)(Oc1ccc(Cl)cc1)C(=O)NC1CC=CC1 160796244 PBMKDERMTHTVRU-UHFFFAOYSA-N 279.767 3.332 70 20 CGID CC(C)C[C@H](CO)NC(=O)CCCCCc1cccs1 160861291 ZXWCRBRKGVFKMK-CQSZACIVSA-N 297.464 3.374 70 20 CGID CNc1ccccc1C(=O)N1CC[C@@H](C(C)(C)C)C1 160953271 IPYSQAUKWNMUFK-GFCCVEGCSA-N 260.381 3.237 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)[C@@H]1CCOc2ccccc21 159839509 NATPNQWHLOQUQH-BPLDGKMQSA-N 273.376 3.248 70 20 CGID CC[C@H](C)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159475294 BMZXNAKLTIYDCP-OFQRWUPVSA-N 275.392 3.317 70 20 CGID COc1ccccc1NC(=O)[C@H](C)Sc1ccncc1 159949721 CEZWVRUDAOIWLA-NSHDSACASA-N 288.372 3.210 70 20 CGID CNCC[C@@H]1CCCCN1C(=O)c1cccc(C)c1Cl 160394027 PNBZEUZJEIHYQP-ZDUSSCGKSA-N 294.826 3.253 70 20 CGID Cc1ccc(CNC(=O)Nc2cc(Cl)ccn2)cc1 217315228 DOTCMSLTILPLFX-UHFFFAOYSA-N 275.739 3.365 70 20 CGID Cc1ccc(CCNC(=O)Nc2nc(C)c(C)s2)cc1 217307865 LKYURSBYMPAAEZ-UHFFFAOYSA-N 289.404 3.433 70 20 CGID C[C@@H](NCC1(c2ccc(F)cc2)CC1)C1CCN(C)CC1 161380363 ORZDUTLYUYTZLN-CQSZACIVSA-N 290.426 3.177 70 20 CGID Cc1cccc([C@H](C)CNC(=O)NC2(C)CCC2)c1 161481420 YOQFTBXCRNPQRL-CYBMUJFWSA-N 260.381 3.340 70 20 CGID COCCCC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 160168464 CSPGKMLFVITKCV-SFHVURJKSA-N 298.386 3.022 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc2c(c1)NC(=O)CS2 160183833 OMEOLZUGFIQAIK-MEBBXXQBSA-N 290.388 3.106 70 20 CGID C[C@H](CO)N(C)C(=O)c1ccc(-c2ccc(F)cc2)s1 160467082 JKXSYYWAELPRGJ-SNVBAGLBSA-N 293.363 3.007 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)n1 159611072 YNYVSZLDUALIGB-AEJSXWLSSA-N 281.425 3.061 70 20 CGID Cc1nccn1CCCCNc1nc(C(C)(C)C)ns1 159631250 NQPKXCGCNATYLZ-UHFFFAOYSA-N 293.440 3.233 70 20 CGID CC(C)n1nccc1C(=O)N1C[C@H](C)CCC[C@H]1C 159490693 USJSJWSIRCVLEY-CHWSQXEVSA-N 263.385 3.115 70 20 CGID Cc1cc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c(C)o1 159692053 OGAPIQOWDJHBMT-CYBMUJFWSA-N 277.364 3.118 70 20 CGID CCOC(=O)NCCCC(=O)Nc1cccc(C)c1Cl 159572279 AFDFSQCATHLYEB-UHFFFAOYSA-N 298.770 3.113 70 20 CGID CO[C@H](CNc1nc(C(C)(C)C)ns1)C(C)(C)C 159780581 HDXKWQHJESIONX-SECBINFHSA-N 271.430 3.309 70 20 CGID CCC(CC)(CNCC(C)C)NC(=O)OC(C)(C)C 218119678 OIMRRZPYDIRRTL-UHFFFAOYSA-N 272.433 3.316 70 20 CGID Cc1ccc(CCNC(=O)N[C@H]2CCCC[C@H]2C)cc1 217307833 IOLWPNDQDLZWKP-ZBFHGGJFSA-N 274.408 3.415 70 20 CGID O=C(NC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccnc1Cl 160009008 ABOYQVABKSOQRO-ZNMIVQPWSA-N 298.773 3.051 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)NC(CC)CC 160074229 YRYDJWKMWPUXKW-NSHDSACASA-N 298.452 3.472 70 20 CGID CCC(=O)N1CCCC[C@@H]1C(=O)N(CC)CC(CC)CC 160210254 UIYUGCUMTQJMIM-OAHLLOKOSA-N 296.455 3.062 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)c1cccc(F)c1 160701313 SNDPZKBJRNNLJC-JTQLQIEISA-N 291.347 3.279 70 20 CGID Cc1ccccc1OCCCNC(=O)NC1(C)CCC1 160834767 AGIFXUFJRNURRG-UHFFFAOYSA-N 276.380 3.006 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cccc(-n2cccn2)c1 159626893 RNSPQVMNRJOVDP-XJKSGUPXSA-N 283.375 3.181 70 20 CGID Cc1ccnc(N(C)Cc2nccn2Cc2ccccc2)c1 159703101 FLIDPHNZJZQVBH-UHFFFAOYSA-N 292.386 3.271 70 20 CGID CC[C@H](NC(=O)Nc1ccnc(C)c1Cl)[C@@H]1CCCO1 159942673 SASOHPKFPNMZON-JQWIXIFHSA-N 297.786 3.123 70 20 CGID Cc1cccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159477518 FIHCJSVEIACDBL-XHSDSOJGSA-N 257.377 3.042 70 20 CGID CC(C)[C@@H](CCO)NC(=O)c1cc2ccccc2s1 160675049 MKECWRUZJFVLCO-GFCCVEGCSA-N 277.389 3.038 70 20 CGID CN(Cc1ccccc1)C(=O)NCCc1ccc(F)cc1 217524382 ZDAANLAKXLIANA-UHFFFAOYSA-N 286.350 3.210 70 20 CGID CCCN1CCCN(C(=O)c2cc(Cl)ccc2F)CC1 160361388 YRVKHQIPJNQVPQ-UHFFFAOYSA-N 298.789 3.037 70 20 CGID Cc1c(C(=O)N[C@H]2CCC[C@H](N)C2)oc2c(C)cccc12 161063314 MSWIBFBJDRVHHY-STQMWFEESA-N 286.375 3.049 70 20 CGID Cc1ccc(NC(=O)NCCOC2CCCCCC2)cn1 161333295 HEMJAKGMHBLLPL-UHFFFAOYSA-N 291.395 3.251 70 20 CGID C[C@H](NCc1csc(-c2ccccc2)n1)c1cnccn1 161485137 FKWTUMVNMIDVLS-LBPRGKRZSA-N 296.399 3.451 70 20 CGID CS[C@@H](C)CC(=O)Nc1cccc(Cl)c1N(C)C 160001254 UQRKCDRPZDJJPN-VIFPVBQESA-N 286.828 3.486 70 20 CGID CC[C@H](C)N(Cc1ccccc1)C(=O)[C@@H]1CCCCO1 160055408 WLMIMYCCVXTGAC-HOCLYGCPSA-N 275.392 3.383 70 20 CGID Cc1cccc(CC(=O)N[C@@H]2CCOC3(CCCC3)C2)c1 160204112 PBUDZPXPKFJCSO-MRXNPFEDSA-N 287.403 3.146 70 20 CGID CC[C@@H](NC(=O)c1ccc(F)cc1F)c1c(C)noc1C 160226749 OIXDEEUXWCROJH-CYBMUJFWSA-N 294.301 3.451 70 20 CGID CC[C@@H](NC(=O)CCCCSC)c1c(C)noc1C 160311970 YITWGSZNNOJJRN-GFCCVEGCSA-N 284.425 3.392 70 20 CGID CC(C)CC(C)(C)C(=O)N(C)Cc1cccn1C 160418784 LZFLDXMURINVEQ-UHFFFAOYSA-N 250.386 3.056 70 20 CGID Clc1cc(N[C@H]2CCO[C@H](C3CC3)C2)nc(C2CC2)n1 160474116 LAXUWAXXWYUWAX-RYUDHWBXSA-N 293.798 3.377 70 20 CGID CCc1cc(O)nc(CN[C@H](C)c2ccc(Cl)cc2)n1 160541895 IRGWRTSRMRPDDB-SNVBAGLBSA-N 291.782 3.249 70 20 CGID CC(C)c1ccc(CN(C)Cc2cnc(N(C)C)nc2)cc1 160668046 WCVXZGJLECWYHC-UHFFFAOYSA-N 298.434 3.298 70 20 CGID C[C@@H]1CCC[C@H](CC(=O)N(C)Cc2cccn2C)C1 160712865 CVJNDZQYGXGAAO-KGLIPLIRSA-N 262.397 3.200 70 20 CGID O=C(Nc1cccc(F)n1)c1ccccc1OCC1CC1 160741124 JGSQLAHDQOYBHC-UHFFFAOYSA-N 286.306 3.262 70 20 CGID CC[C@H](NCCCCN1CCC[C@@H]1CO)C1CCCCC1 160761238 WADDDWDJTYIHBJ-MSOLQXFVSA-N 296.499 3.172 70 20 CGID CC(C)NC(=O)CN[C@H]1CCCCc2ccc(Cl)cc21 160959658 MNQGCCAWISKCGO-HNNXBMFYSA-N 294.826 3.222 70 20 CGID COCc1nc(C)c(C(=O)N(C2CC2)[C@@H](C)C(C)C)s1 159719913 ZGARBUGNSDVWII-NSHDSACASA-N 296.436 3.247 70 20 CGID COc1cc(CCC(=O)NC2CCCC2)ccc1Cl 159524926 DHEKVJQQWQEAQW-UHFFFAOYSA-N 281.783 3.340 70 20 CGID Cc1ccccc1NC(=O)C[C@H](C)N[C@H]1CCCSC1 159535225 FTBGFDKLEPDRFT-KBPBESRZSA-N 292.448 3.197 70 20 CGID CC[C@H]1CN(C(=O)[C@@H](C)Cc2ccccc2F)C[C@@H](C)O1 159781689 IYPAMVJAGORJSR-GUTXKFCHSA-N 293.382 3.030 70 20 CGID C[C@H](NC(=O)c1cccc2[nH]cnc12)[C@H](C)c1ccccc1 159787890 DLLYDDFWZBCIIM-STQMWFEESA-N 293.370 3.485 70 20 CGID Fc1ccc2c(c1)[C@H](N[C@H]1CCCSC1)CC2 159595823 QGPBOZWJPDDPJN-GXTWGEPZSA-N 251.370 3.298 70 20 CGID CSc1ccsc1C(=O)N(C)Cc1cccn1C 160399027 KPNROVIJGGLTKH-UHFFFAOYSA-N 280.418 3.081 70 20 CGID CC(C)(C)CNC[C@H]1CCCCN1C(=O)OC(C)(C)C 218148408 SABMJDWEGYHLHO-CYBMUJFWSA-N 284.444 3.412 70 20 CGID CN(C(=O)[C@@]1(C)CCNC1)c1ccc(-c2ccccc2)cc1 161082192 JPEXADFGXFKQRM-IBGZPJMESA-N 294.398 3.316 70 20 CGID CC(=O)NC1CCC(Nc2ccc(OC(C)C)cc2)CC1 161084229 KLWKULPBQRISFP-UHFFFAOYSA-N 290.407 3.333 70 20 CGID CC[C@@H](C(=O)N[C@H](C)C1CCOCC1)c1ccc(F)cc1 161138036 HVBQNLYNZMSGBX-MLGOLLRUSA-N 293.382 3.251 70 20 CGID COC[C@H](NC(=O)[C@H](C)Cc1ccccc1Cl)C1CC1 161251356 MJLIPRGKVMVBMQ-ABAIWWIYSA-N 295.810 3.060 70 20 CGID CO[C@H](C(=O)N1c2ccccc2C[C@H]1C)c1ccccc1 161258347 GWSCDSFBBXAIKO-DYVFJYSZSA-N 281.355 3.352 70 20 CGID C[C@H]1C[C@H](NCC2(c3ccc(F)cc3)CC2)[C@H](C)CN1C 161359550 UXPCPICRXBWRLF-KEYYUXOJSA-N 290.426 3.176 70 20 CGID C/C(=C/C(=O)NCCCC(C)(C)CO)c1ccccc1 160358086 JITIYNGNDKVRTP-OWBHPGMISA-N 275.392 3.005 70 20 CGID O=C(C[C@H]1C=CCC1)N[C@@H]1CCOC2(CCCCC2)C1 160401998 ITDKRSBVDUCOSG-LSDHHAIUSA-N 277.408 3.341 70 20 CGID CCc1ccccc1C(=O)NC[C@H]1CCCN1CC(C)C 160571378 CKHPOKSOPSPPQK-MRXNPFEDSA-N 288.435 3.099 70 20 CGID CS[C@@H](C)CNC(=O)c1cccc(C(F)(F)F)c1F 159402749 RGTNBPDDQRNTFA-ZETCQYMHSA-N 295.301 3.326 70 20 CGID CC[C@H](NCCc1cc(C)cc(C)c1)c1cnn(C)c1 159454981 JLVXCZYZSYHXJU-KRWDZBQOSA-N 271.408 3.320 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CCCC[C@H]1C 159464908 VVWKTQJZZLGOIR-LLVKDONJSA-N 285.347 3.060 70 20 CGID Cc1cc(F)c(C(=O)Nc2ncccc2C)cc1F 159876191 OKAUDNODCCCKOG-UHFFFAOYSA-N 262.259 3.229 70 20 CGID CCC1(C(=O)N[C@H]2CCOC3(CCCC3)C2)CCC1 159905816 VAONVYNWVHQZIB-ZDUSSCGKSA-N 265.397 3.175 70 20 CGID CC1=C(C(=O)NCCc2cccc(Cl)c2)CCCO1 159511390 GDJXGADCMOHCMP-UHFFFAOYSA-N 279.767 3.083 70 20 CGID COCCC1(CNC(=O)CCc2cc(C)cc(C)c2)CC1 159764704 LUVOMBLPVKTPPQ-UHFFFAOYSA-N 289.419 3.169 70 20 CGID CCCC[C@H](CC)CNC(=O)c1ccc(OC)cc1O 218085028 JVGZHENLPKFVFN-LBPRGKRZSA-N 279.380 3.347 70 20 CGID CC(C)c1ccc(S(=O)(=O)N2[C@H]3C=CC[C@H]2CC3)cc1 218758352 CDRISKVTISDTCD-GJZGRUSLSA-N 291.416 3.292 70 20 CGID CC(C)N(CC(F)(F)F)C(=O)C[C@H](C)c1ccncc1 160047872 IDSNEQCFPLFJKD-NSHDSACASA-N 288.313 3.375 70 20 CGID c1ccc2c(CN3CCC([C@@H]4CCCN4)CC3)coc2c1 161112259 RUUGNRQRHRFWAY-KRWDZBQOSA-N 284.403 3.397 70 20 CGID CO[C@@H](C)C(=O)N1CCCC[C@@H]1CCCc1ccccc1 161169288 QIWMFIFNFQNLMK-DOTOQJQBSA-N 289.419 3.425 70 20 CGID C[C@H](NC(=O)N[C@@H]1C=CCCC1)c1ccc(F)cc1F 161357859 RCEPHGXZIKVKFN-CMPLNLGQSA-N 280.318 3.434 70 20 CGID CCCn1nccc1CN[C@H](C)COc1ccc(C)cc1 160111458 VDNGALARADQKAV-OAHLLOKOSA-N 287.407 3.159 70 20 CGID CC[C@@H](NCC1(CO)CCCC1)c1ccc2c(c1)CCO2 160121137 VEKPBMYZPIUBIB-MRXNPFEDSA-N 289.419 3.215 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCCc1cc(C)ccc1OC 160169963 IFEKKSGKAFMJPF-PBHICJAKSA-N 275.392 3.099 70 20 CGID CC[C@H]1CCCN(C(=O)c2cc([C@@H](C)CC)no2)C1 160324913 RKTPDEPKQXXKMX-RYUDHWBXSA-N 264.369 3.450 70 20 CGID Cc1cc(N[C@H]2CCO[C@H](c3ccccc3)C2)ncn1 160531762 JGJSDDAMKOCRGS-GJZGRUSLSA-N 269.348 3.117 70 20 CGID Cc1c(NCc2coc3ccccc23)cccc1C(N)=O 159807727 VXCNUTQPEIARTF-UHFFFAOYSA-N 280.327 3.452 70 20 CGID CCO[C@H](C)C(=O)N1C[C@@H](C)CSc2ccccc21 159520838 MFZMCQRJZJUIDI-VXGBXAGGSA-N 279.405 3.186 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2NC(=O)CCC(F)(F)F 159368433 YJINIFIQFRUTSF-LBPRGKRZSA-N 286.297 3.105 70 20 CGID CCCC1(CNC(=O)c2cccc3[nH]ccc23)CC1 160609463 QREVAQKMFPEOOU-UHFFFAOYSA-N 256.349 3.478 70 20 CGID CCc1ncnc(NCc2cccc3cccnc23)c1F 217994804 PLNFAZMUAZCIIO-UHFFFAOYSA-N 282.322 3.338 70 20 CGID O=C(NCc1ccccn1)Nc1c(F)cccc1Cl 217313139 FBFDHYQSRPBVHN-UHFFFAOYSA-N 279.702 3.196 70 20 CGID CC(C)[C@H](CC(=O)N[C@@H]1CCC[C@H](N)C1)c1ccccc1 161053426 OUWSCDSPTVHOEJ-BBWFWOEESA-N 288.435 3.202 70 20 CGID Cc1ccsc1CCCC(=O)N1C[C@H](C)OC[C@H]1C 161133069 HEAQUOXXSYDOAY-OLZOCXBDSA-N 281.421 3.015 70 20 CGID COc1ccc(NC(=O)C[C@H]2CCC[C@@H](C)C2)cc1N 161230441 WKDGMBOBHDQJSQ-NEPJUHHUSA-N 276.380 3.432 70 20 CGID CCCc1cc(=O)oc2cc(OCc3ccnn3C)ccc12 161233733 JEHOUGKSAVCDIP-UHFFFAOYSA-N 298.342 3.058 70 20 CGID COc1ccc(OCCCC(=O)N2[C@@H](C)CC[C@H]2C)cc1 161441902 NUQWKVVKUDNSRP-OKILXGFUSA-N 291.391 3.254 70 20 CGID Cc1ccc(NC(=O)NCCc2c(F)cccc2F)cn1 161502283 ILIZENSIULPIBG-UHFFFAOYSA-N 291.301 3.032 70 20 CGID C[C@@H]1CCC[C@H](C(=O)N(C)c2ccc3c(c2)OCO3)C1 160089291 AOZMXTSSQBVREX-NEPJUHHUSA-N 275.348 3.204 70 20 CGID CCC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 160120687 PHOHUPIECSMKFT-INIZCTEOSA-N 254.333 3.006 70 20 CGID CC1(C)C[C@H](NC2CCN(C3CCCC3)CC2)C(C)(C)O1 160501483 UXXJIMATUKJVHR-INIZCTEOSA-N 294.483 3.329 70 20 CGID COc1ccc(C(C)(C)C(=O)N2CCCC[C@@H]2C)cc1 159468614 SBESPSLQZQJIKG-ZDUSSCGKSA-N 275.392 3.374 70 20 CGID CC[C@@H](NCCc1cc(C)cc(C)c1)[C@@H]1CCOC1 159498870 HXAFESIJJNBSKZ-IAGOWNOFSA-N 261.409 3.251 70 20 CGID Cc1c(NCc2ccc(Cl)cc2F)cccc1C(N)=O 160714978 SJTPIBRORMNJBL-UHFFFAOYSA-N 292.741 3.499 70 20 CGID CC[C@H](C(=O)N[C@H](C)C1CCOCC1)c1ccc(F)cc1 161137915 HVBQNLYNZMSGBX-WBMJQRKESA-N 293.382 3.251 70 20 CGID N[C@H]1CCCCCC[C@H]1C(=O)N1CCC2(CCCCC2)C1 161196637 WZRVWNDVFHEKGV-CVEARBPZSA-N 292.467 3.467 70 20 CGID C[C@@H](NC(=O)Cc1ccc(O)cc1Cl)C(C)(C)C 161424744 IHOVQYIDBLOJHI-SECBINFHSA-N 269.772 3.139 70 20 CGID CC[C@H](C)OCC(=O)N[C@H](C)[C@@H](C)c1ccccc1 160023016 USCCYIRAGPNTQH-BFHYXJOUSA-N 263.381 3.110 70 20 CGID COc1cc(N[C@@H](C)c2cscn2)ccc1F 160048553 HQTMZDFFKCQUDG-QMMMGPOBSA-N 252.314 3.464 70 20 CGID CCCn1nc(C)c([C@H]2NC(=O)c3cccc(C)c3N2)c1C 160146512 OJXXBQZVOAGFNG-MRXNPFEDSA-N 298.390 3.072 70 20 CGID CC1(C(=O)N[C@H]2CCSc3c(F)cccc32)CC1 160161510 UUKKKOGIJIOXFL-NSHDSACASA-N 265.353 3.279 70 20 CGID C[C@@H](CNC(C1CC1)C1CC1)N1CCc2ccccc2C1 159800037 CUBDRCAVJPXJGS-AWEZNQCLSA-N 284.447 3.211 70 20 CGID Cc1cccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c1 159804997 URUXBLGSNPKWBH-OAHLLOKOSA-N 273.376 3.217 70 20 CGID CC(C)C[C@H](N)C(=O)N[C@@H](C)c1ccc(F)cc1Cl 159624633 SLORBJDVEBLQOO-ZANVPECISA-N 286.778 3.030 70 20 CGID CCC(CC)(CC)CNC(=O)N[C@H](COC)c1ccco1 159869277 GZKQAPQWMYKFPI-CYBMUJFWSA-N 296.411 3.483 70 20 CGID O=C(Nc1cc(C2CCCCCC2)[nH]n1)[C@@H]1CCCCO1 159525625 JDKBGXDKNXMVDF-AWEZNQCLSA-N 291.395 3.355 70 20 CGID CC[C@H](NC(=O)c1ccc(F)cc1)c1c(C)noc1C 159942488 GZVCJXFAEBTHEE-ZDUSSCGKSA-N 276.311 3.312 70 20 CGID Cc1c(F)cccc1NC(=O)CCCn1cccc1 159775405 MBEGEVOEAKRAJO-UHFFFAOYSA-N 260.312 3.355 70 20 CGID CC[C@H](NC(=O)CC1CCSCC1)c1c(C)noc1C 159990967 ALPGIPGZFVXGLH-ZDUSSCGKSA-N 296.436 3.392 70 20 CGID CC(C)n1cc(NCc2cccc3c2NCCC3)cn1 159411364 KOGNNYOERDKABF-UHFFFAOYSA-N 270.380 3.434 70 20 CGID CCNCC1CCN(Cc2coc3ccccc23)CC1 161118348 RBFSKBNPJHUYIX-UHFFFAOYSA-N 272.392 3.254 70 20 CGID C[C@H](NCC(=O)Nc1ccc(Cl)cc1)c1cncs1 161103802 NGMNAIUXNSEOJB-VIFPVBQESA-N 295.795 3.086 70 20 CGID CCC[C@@H](COCc1ccccc1)CS(=O)(=O)Cl 114476500 IVRZGSHCMWMRHF-ZDUSSCGKSA-N 290.812 3.188 70 20 CGID C[C@@H]1CCC[C@@H](C)C1NC(=O)Nc1ccc2c(c1)OCO2 217235115 PEFBREKDOADQIZ-GHMZBOCLSA-N 290.363 3.362 70 20 CGID CC1(C)C(CNC(=O)N2CCCCCC2)C1(C)C 160670669 HVBKRRRFOVDOQO-UHFFFAOYSA-N 252.402 3.254 70 20 CGID Cc1cccc(C)c1OCCCN[C@H]1CCN(C)C[C@@H]1C 161234657 HBYRTFVHLPHQMG-IRXDYDNUSA-N 290.451 3.002 70 20 CGID CCc1cnc(NC(=O)N(CC2CC2)CC2CC2)s1 161278865 RQQUVXOVYQMLSQ-UHFFFAOYSA-N 279.409 3.359 70 20 CGID CCCn1c(C)nnc1COc1ccc(Cl)cc1F 161429047 CIQACPCMHMGLIA-UHFFFAOYSA-N 283.734 3.368 70 20 CGID C[C@@H](N(C)CC1CCN(C(=O)C(C)(C)C)CC1)C1(C)CC1 160097528 QDROGSXWEMHZFT-CQSZACIVSA-N 294.483 3.392 70 20 CGID CC[C@H](SC)C(=O)N[C@H]1CCCc2sccc21 160161156 LLDNWPSCDUQPQL-QWRGUYRKSA-N 269.435 3.383 70 20 CGID CC[C@@H](CN[C@H](C)c1cnccn1)Oc1ccccc1F 160316089 VRFRAQIAKUBHER-OLZOCXBDSA-N 289.354 3.124 70 20 CGID Cc1ccc(OCCCNC(=O)NC2(C)CCC2)cc1 160415907 IMHMABHLRZURHN-UHFFFAOYSA-N 276.380 3.006 70 20 CGID C[C@H](C1CC1)N(Cc1ccccc1)C(=O)[C@H]1CCCCO1 160849195 VXPBNOBMWFWVEI-RHSMWYFYSA-N 287.403 3.383 70 20 CGID c1cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2cc[nH]c2c1 159571753 WVOHFQQIMWZUEM-UAGQMJEPSA-N 282.387 3.215 70 20 CGID OCC1(CNCc2ccccc2C(F)(F)F)CCCC1 160076177 KUTQATKDYGGLDW-UHFFFAOYSA-N 287.325 3.348 70 20 CGID CC(C)n1cccc1C(=O)N(C)Cc1ccccc1 160505886 JFRXQZSFYWTFSL-UHFFFAOYSA-N 256.349 3.341 70 20 CGID CN(C)[C@H](CNCc1ccc(Cl)cc1F)c1ccco1 160658662 VATJBBUBVFDUNU-CQSZACIVSA-N 296.773 3.465 70 20 CGID Cc1cc(NCCCN(C)c2ccccc2)ccn1 160915360 MCJOAFXPZJWNIX-UHFFFAOYSA-N 255.365 3.328 70 20 CGID CC1CCN(C(=O)N[C@@H]2CCCC(C)(C)C2)CC1 160722082 IXSWVCMQIIYOIZ-CYBMUJFWSA-N 252.402 3.397 70 20 CGID CC(C)(C)CCC(=O)Nc1ccc(S(=O)(=O)F)cc1 776368045 NAAFBPPPGCISOI-UHFFFAOYSA-N 287.356 3.110 70 20 CGID C[C@@H](c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](CN)C1 217513571 IBGDPNFHYIAESK-RYUDHWBXSA-N 286.341 3.437 70 20 CGID Cc1nc(C)c(C(=O)N2CCC(C)(c3ccccc3)CC2)o1 161156671 QLSWQHYCQZFHAC-UHFFFAOYSA-N 298.386 3.485 70 20 CGID C[C@@H](Cc1cccc(Cl)c1)C(=O)NC1(C)CCOCC1 161510824 ALXPMJUORJFHFU-LBPRGKRZSA-N 295.810 3.204 70 20 CGID CC[C@@H](Oc1ccccc1F)C(=O)NCC1(C2CC2)CC1 160014791 JPJNSROKYWXXIS-CQSZACIVSA-N 291.366 3.290 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)CC[C@H]1CCOC1 160121553 LXLHSFKZQOWZIS-KBPBESRZSA-N 292.375 3.425 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1ccc(OC)cc1OC 160136630 CNUONRHGRRMYSV-KGLIPLIRSA-N 294.439 3.085 70 20 CGID C[C@@H](C(=O)O[C@H](c1ccccn1)C(F)(F)F)C1CC1 160250656 DIRBVVQZQWEEEY-LDYMZIIASA-N 273.254 3.274 70 20 CGID CC(C)CCn1ccc(NC(=O)NCCC(F)(F)F)n1 160377734 ZOQIUDDNQZEQPV-UHFFFAOYSA-N 292.305 3.003 70 20 CGID CCc1nc(CN[C@@H](C)c2ccccc2C(F)(F)F)n[nH]1 160468433 MILYENOFVVEHSA-VIFPVBQESA-N 298.312 3.237 70 20 CGID CCOc1cccc([C@H](C)NC[C@H]2CCCC[C@@H]2O)c1 160540096 BLPHMKMXJINTCO-LXZKKBNFSA-N 277.408 3.287 70 20 CGID CCCCCOCC(=O)N[C@H]1CCOC2(CCCCC2)C1 160806915 CGWKVBQWWUDJSK-HNNXBMFYSA-N 297.439 3.191 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c(C)c1 160934061 NAEMHJUGDLDBRK-ZBFHGGJFSA-N 288.391 3.383 70 20 CGID Cc1cccc(N(C)C(=O)Cc2cc(F)c(F)cc2F)n1 160974208 ZTTDVLGMYJYGQL-UHFFFAOYSA-N 294.276 3.013 70 20 CGID CC[C@H]1CCCCN1C(=O)Nc1cc(C(=O)OC)cs1 160980990 TURCFROAYHZORX-NSHDSACASA-N 296.392 3.331 70 20 CGID CN(Cc1cccn1C)C(=O)C(C)(C)c1ccc(F)cc1 160996852 QDGLFDQMVHQTOE-UHFFFAOYSA-N 288.366 3.100 70 20 CGID CC(C)[C@H]1CCCC[C@@H]1NC1CCC2(CC1)OCCO2 160341205 HBERXSCEGNGAET-CVEARBPZSA-N 281.440 3.477 70 20 CGID CC[C@H](C)NCc1ccc(N2CCC(C)CC2)nc1 160497584 ZPJJCWBFQAOJLL-AWEZNQCLSA-N 261.413 3.206 70 20 CGID Cc1cn2c(CN[C@@H]3CCOC(C)(C)C3)c(C)nc2s1 160478934 HQOALCSMVQZACR-GFCCVEGCSA-N 293.436 3.060 70 20 CGID NC(=O)c1cc(NCc2ccc(Cl)cc2F)ccc1F 160718012 LOKIWUOBEPITRO-UHFFFAOYSA-N 296.704 3.329 70 20 CGID CCc1cc(C(=O)Nc2ccc(OC)c(N)c2)sc1C 160984126 ZNJJRNQGUZMDIF-UHFFFAOYSA-N 290.388 3.462 70 20 CGID Cc1nc(C)c(CN(C)Cc2cccc(N(C)C)c2)s1 159853532 DFNUQGZLXSPCEO-UHFFFAOYSA-N 289.448 3.458 70 20 CGID CN(Cc1cscn1)Cc1csc(C2CC2)n1 161460346 KOVPQADWZHQLIS-UHFFFAOYSA-N 265.407 3.109 70 20 CGID C[C@H](N)C(=O)Nc1cc(C2CCC(C(C)(C)C)CC2)n[nH]1 161068829 BIPFJSXBZMLSSY-UNXYVOJBSA-N 292.427 3.015 70 20 CGID Cc1ccc(C(N)=O)cc1NCc1ccc([C@@H]2C[C@H]2C)o1 160025529 SKVNMWUWOGQDLS-BXUZGUMPSA-N 284.359 3.422 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)[C@@H](CC)CC1CCCC1 160083515 REHRWWFQTGLNOC-JSGCOSHPSA-N 283.412 3.051 70 20 CGID CC[C@@H](NC(=O)[C@H]1CC=CCC1)c1c(C)noc1C 160104142 LULORQCPYARZHJ-QWHCGFSZSA-N 262.353 3.215 70 20 CGID C[C@@H](NC(=O)C1(Cc2ccccc2)CCC1)C1CC1 160105892 AXUQRGKRPDVOCV-CYBMUJFWSA-N 257.377 3.314 70 20 CGID CCC[C@H](N[C@H](CCO)CSC)c1ccccc1 160148538 RYUSPLYNNVEROO-CABCVRRESA-N 267.438 3.231 70 20 CGID CCOc1cccc([C@@H](CC)OC(=O)[C@@H]2CCCO2)c1 160165762 VOGLDEFCZWWRRY-CABCVRRESA-N 278.348 3.259 70 20 CGID Cc1ccc2cccc(NC(=O)NC3CC=CC3)c2n1 160237187 BQHLBVYWVHLAAL-UHFFFAOYSA-N 267.332 3.383 70 20 CGID Cc1nc2ccccn2c1CN1CCCC(C)(C)C1 160384255 GYHYYKXVGJDWRZ-UHFFFAOYSA-N 257.381 3.265 70 20 CGID Cc1ncccc1C(=O)N[C@H]1CCOC2(CCCCC2)C1 160445223 RINGEMKWXHZHTM-AWEZNQCLSA-N 288.391 3.002 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccccc1OC 160584752 PQOBGWPTMUUGMZ-KGLIPLIRSA-N 292.423 3.390 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Cc1ccc(C)nc1 160905485 FGAZBRIGQDIKNN-CVEARBPZSA-N 274.408 3.360 70 20 CGID Cc1nc(C)c(CCNC(=O)CCC(C)(C)C)s1 159499985 GNJZUECCIMUIMM-UHFFFAOYSA-N 268.426 3.245 70 20 CGID CCCN(CC)c1ccc(C(=O)N(CC)CC(C)C)cn1 159924361 DNENZJQJVNUDOK-UHFFFAOYSA-N 291.439 3.436 70 20 CGID Cc1cc(NC(=O)[C@@H](C)OC2CCCCCC2)no1 159599382 YIPVNOBHPSDNNY-LLVKDONJSA-N 266.341 3.049 70 20 CGID O=C(c1cc(-c2ccccc2)n[nH]1)N1[C@H]2C=CC[C@H]1CC2 218725141 UCSQJEBZBFTMSU-KBPBESRZSA-N 279.343 3.010 70 20 CGID COC[C@H](NC[C@@H](C)COCc1ccccc1)C(C)C 161307685 XKGANAGHGNJJOF-WBVHZDCISA-N 279.424 3.100 70 20 CGID Cc1cccc(NC(=O)c2ccc(C(C)C)nc2)n1 160088009 JFTMHQLMEJLXOY-UHFFFAOYSA-N 255.321 3.161 70 20 CGID C[C@H](N[C@@H](C)C1CC1)c1ccc(OCc2nccn2C)cc1 160118159 WUJDHRVYFBXOND-KBPBESRZSA-N 299.418 3.448 70 20 CGID O=C(CC1CCC1)O[C@H](c1ccccn1)C(F)(F)F 160231322 WBTDQAWNDNLDIW-GFCCVEGCSA-N 273.254 3.418 70 20 CGID O=C(N[C@@H]1CCSc2c(F)cccc21)[C@H]1CCCCO1 160308167 KPKVXIQJMMCRGL-CHWSQXEVSA-N 295.379 3.048 70 20 CGID Cc1cccc2nc(CN[C@H](C)C3CCCC3)cn12 160339804 MWOFTFBTOWHZSQ-CYBMUJFWSA-N 257.381 3.311 70 20 CGID CC(=O)Nc1cccc(NC(=O)N[C@@H](C)C2CCC2)c1C 160369925 GKNKYDNBKRBYRS-NSHDSACASA-N 289.379 3.264 70 20 CGID CN(C(=O)CCC(C)(C)C)c1ccc2c(c1)OCO2 160486369 YCHCUDAXBJKFNJ-UHFFFAOYSA-N 263.337 3.204 70 20 CGID CCCCC(=O)NCCc1csc(C(C)(C)C)n1 160657299 SFCBXDZADLXDAW-UHFFFAOYSA-N 268.426 3.290 70 20 CGID CCCC1(CNC(=O)[C@](C)(O)[C@@H](C)c2ccccc2)CC1 160681733 DAJKOYUTLRKUSZ-WMLDXEAASA-N 289.419 3.238 70 20 CGID CC[C@H](NC[C@@H]1CCc2ccccc21)c1cnn(C)c1 160960429 KMHLZFFNXUXKSW-YOEHRIQHSA-N 269.392 3.191 70 20 CGID C[C@@H]1SCCN(CCn2ccnc2)[C@@H]1c1ccccc1 159834871 YXFMJZNZDCUPCO-HOCLYGCPSA-N 287.432 3.062 70 20 CGID CCC(C)(CC)C(=O)NCC[C@@H](C)N1CCCCC1 159477218 YKMOCRMFBRAFJA-CQSZACIVSA-N 268.445 3.193 70 20 CGID CCC(C)(CC)C(=O)NC[C@H](C)c1ncc(C)s1 159483646 YETOENMWQLVWTO-JTQLQIEISA-N 268.426 3.498 70 20 CGID C[C@H](O)CN(C)[C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1 159523272 HOYZFKSYZQXKGP-QWRGUYRKSA-N 294.782 3.369 70 20 CGID CC(C)NCCC(=O)N(C)[C@@H](c1ccccc1)C(C)C 159756126 XDIYILAAFJYYFP-QGZVFWFLSA-N 276.424 3.230 70 20 CGID Clc1ccc(CCNCc2cn3ccccc3n2)s1 218242033 YWKPAMSCCUZPBJ-UHFFFAOYSA-N 291.807 3.382 70 20 CGID O=C(NCC1CCCC1)Nc1ccc(Cl)cn1 217578935 VUYYXEPLZLVMDX-UHFFFAOYSA-N 253.733 3.047 70 20 CGID O=C(Cc1ccc(O)cc1)N[C@@H]1CCCc2sccc21 160440106 XNXNLSUGWUSIMI-CQSZACIVSA-N 287.384 3.190 70 20 CGID CC(C)[C@H]1CCCCN1CCCN1CCCCC1 161151824 NGDHCWVXGLAFLH-MRXNPFEDSA-N 252.446 3.373 70 20 CGID Cn1ncc2c1CCC[C@@H]2NC[C@H]1CCc2ccccc21 161006224 NCABOFDQVJZGCC-PBHICJAKSA-N 281.403 3.117 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1c1nc(-c2cnccn2)no1 161030027 UZYSVTOTZYZFEH-NXEZZACHSA-N 284.344 3.168 70 20 CGID Cc1cc(NC(=O)CCC(C)(C)c2ccccc2)nn1C 161177785 HNKNWKBZPDJQQJ-UHFFFAOYSA-N 285.391 3.425 70 20 CGID CO[C@@]1(C)C[C@@H](N(C)C(=O)Nc2ccc(C)nc2)C1(C)C 161324300 VBKWTVUYWHGNIH-CJNGLKHVSA-N 291.395 3.057 70 20 CGID Cc1nc(C2(NCc3cccc(F)c3)CCCC2)no1 161369178 CVENJFBFBAVSIL-UHFFFAOYSA-N 275.327 3.076 70 20 CGID C[C@H](N[C@H](C)c1ccc([S@@](C)=O)cc1)c1ccco1 160204492 QBXAIQXRPLQNGP-UFYHVXEKSA-N 277.389 3.429 70 20 CGID CCS(=O)(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 160346584 XZZKEAOOEQGLOM-UKRRQHHQSA-N 281.421 3.118 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)NC(C1CC1)C1CC1 160433500 LXDYCAZHVZDWBN-QWHCGFSZSA-N 275.417 3.465 70 20 CGID C[C@@H]1C[C@@H](NCC2(Sc3ccccc3)CC2)CCN1C 160476005 OMWSFKPFOYIPRP-CABCVRRESA-N 290.476 3.384 70 20 CGID CCC(CC)n1nccc1C(=O)N1CCC[C@H](C)C1 160515139 VWZZMZRPSPPQAZ-LBPRGKRZSA-N 263.385 3.116 70 20 CGID C[C@@H](NC[C@H]1CCCC[C@@H]1O)c1cc(F)c(F)c(F)c1 160533835 VSDJBDBUBOBFBQ-RULNRJAQSA-N 287.325 3.306 70 20 CGID Cc1ccc(C)c(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)c1 160634976 IHBDPSJBEWLZLC-HNNXBMFYSA-N 292.423 3.468 70 20 CGID C/C(=C\C(=O)NCCc1csc(C(C)(C)C)n1)C1CC1 160702262 UWXZHFVDTOSNBA-PKNBQFBNSA-N 292.448 3.456 70 20 CGID CCOc1ccccc1CN(C)C(=O)[C@@H]1CC1(C)C 159524779 OHAZBEUSQDJKRQ-ZDUSSCGKSA-N 261.365 3.090 70 20 CGID C[C@H](N[C@@H]1CCCc2cc(F)ccc21)C(=O)NC(C)(C)C 159539542 RGAKDKWHGVPGOX-XHDPSFHLSA-N 292.398 3.096 70 20 CGID Cc1ccccc1[C@@H](C)NCc1csc(N(C)C)n1 159750631 HFEZDKYBWPPKMN-GFCCVEGCSA-N 275.421 3.368 70 20 CGID C[C@@H](N[C@H]1CCC[C@@H](N)C1)c1ccc(Br)cc1 160029595 LLDBEDBLOOXQFK-HONMWMINSA-N 297.240 3.370 70 20 CGID Cc1nnc(CN2c3ccccc3S[C@H](C)[C@@H]2C)n1C 161173992 OJLKRJHKCFLYGA-WDEREUQCSA-N 288.420 3.013 70 20 CGID Cc1ccc(NC(=O)N[C@@H](C)c2ncc(C)s2)cn1 161320102 IWFGLMMHVVDDSP-JTQLQIEISA-N 276.365 3.038 70 20 CGID CCCCn1ncc(C(=O)N(C)Cc2ccsc2)c1C 160179307 PHGBKQKIXSEWQL-UHFFFAOYSA-N 291.420 3.325 70 20 CGID CC(C)c1ccc(C(=O)Nc2nnc(C(C)C)s2)cn1 160279506 SGLHXJJKBRNYFZ-UHFFFAOYSA-N 290.392 3.432 70 20 CGID CC[C@H](NCCCCN1CCC[C@@H]1CO)c1cccs1 160700121 RKQRDFQHVOYMEA-CABCVRRESA-N 296.480 3.026 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C2[C@H]3CCC[C@H]23)n1 160963791 TZXFMYVLJYZHID-QWRGUYRKSA-N 296.374 3.019 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]2C2CC2)n1 160997833 PTNIZIJGQWWNGA-CHWSQXEVSA-N 296.374 3.019 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@H]1CCc2c(OC)cccc21 159887416 NFUBKOAQLRWTKX-WFASDCNBSA-N 291.391 3.004 70 20 CGID CCN(C(=O)[C@@H]1CCCCO1)C12CC3CC(CC(C3)C1)C2 159696694 BJIQYQMZILMSBB-KUNBBXKYSA-N 291.435 3.373 70 20 CGID Cc1nnc(SCC(=O)CCC2CCCC2)s1 159987155 QRCLPJOUYTZQQM-UHFFFAOYSA-N 270.423 3.478 70 20 CGID C[C@]1(NCc2ccc(-c3ccc(F)cc3)o2)CCOC1 160184215 SNSBCBBZMULYDJ-INIZCTEOSA-N 275.323 3.354 70 20 CGID Nc1cc2ccccc2cc1C(=O)NCCc1ccccc1 217744935 NUYYXHVRDHUCIZ-UHFFFAOYSA-N 290.366 3.395 70 20 CGID CC[C@@H](C)NC(=O)NCCc1cccc(Br)c1 217474057 YVLSDNLMBUTMHB-SNVBAGLBSA-N 299.212 3.089 70 20 CGID CC[C@H](SCCCS(C)(=O)=O)c1ccc(F)cc1 161330039 BWXMVKWAFKHAIQ-ZDUSSCGKSA-N 290.425 3.445 70 20 CGID COCCOc1cccc(NC(=O)N[C@@H](C)C2CCC2)c1 161365706 VMEGCDAFMLKRCC-LBPRGKRZSA-N 292.379 3.022 70 20 CGID CSC[C@@H](C)C(=O)N1CCc2c(Cl)cccc21 161472723 PGLFXNQSTLNGCN-SECBINFHSA-N 269.797 3.228 70 20 CGID CC[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(CN(C)C)cc1 160101005 OKRMOKXCFNFMPZ-WBVHZDCISA-N 288.435 3.447 70 20 CGID Cc1ccc(S(=O)(=O)NCC2(C3CC3)CC2)c(Cl)c1 160203798 XRNFOKPDGHBDPV-UHFFFAOYSA-N 299.823 3.117 70 20 CGID Cc1cc(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)oc1C 160242243 OQIBNFZHTPCEEA-NSHDSACASA-N 298.342 3.131 70 20 CGID CC(C)n1cc([C@H](C)NCCCN2CCCC[C@H]2C)cn1 160280116 SBUXWDPIUFTGNO-CVEARBPZSA-N 292.471 3.379 70 20 CGID CCC[C@@H](C(=O)NCCOc1ccccc1)C(C)C 160322905 FFGLZWHGDBJARA-OAHLLOKOSA-N 263.381 3.254 70 20 CGID CC(C)(C)c1ccc(S(=O)(=O)Nc2cccnc2)s1 160332747 YMFFAYJNQZIBRH-UHFFFAOYSA-N 296.417 3.241 70 20 CGID Cc1ccc([C@H](C)NCc2cn3c(C)cccc3n2)o1 160341541 RDGJDQBMKGJFGB-ZDUSSCGKSA-N 269.348 3.395 70 20 CGID CC(C)Cc1ccc(C(=O)N(C)Cc2cccn2C)cc1 160605595 BCKQWCGPSGLRIH-UHFFFAOYSA-N 284.403 3.496 70 20 CGID CSc1ccc(CN(C)Cc2c[nH]nc2C)cc1 160918220 HDCCGIGPZSVHBB-UHFFFAOYSA-N 261.394 3.072 70 20 CGID C[C@@H]1CC[C@H](C(=O)Nc2cc(CC3CCCCC3)n[nH]2)O1 159648168 NCVPIJKNWIIZMF-BXUZGUMPSA-N 291.395 3.039 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N(C)Cc1ccc(OC)cc1OC 159493957 DMAXDIIQHHTEKL-RHSMWYFYSA-N 291.391 3.098 70 20 CGID CCC[C@@H](C)CC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 159550441 YBHCSAABCZXJIO-INMHGKMJSA-N 291.435 3.484 70 20 CGID COCCCn1ccc(N[C@H](C)c2ccccc2C)n1 159780377 ARUNSUAJJFDLME-CQSZACIVSA-N 273.380 3.401 70 20 CGID CCS[C@@H]1CCC[C@H]1Nc1ccc(C(=O)OC)c(C)n1 218056423 BNTCGQPVBBKYMS-CHWSQXEVSA-N 294.420 3.263 70 20 CGID CCOCCCN1CCO[C@H](c2ccc(Cl)cc2)C1 159425467 SPZZGBSZPXJWRW-HNNXBMFYSA-N 283.799 3.140 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cc(F)ccc1F 160068185 WPPCYSYMAWDNQY-NEPJUHHUSA-N 270.367 3.346 70 20 CGID C[C@H](C(=O)N1CCC[C@@H](C)C1)c1c(F)cccc1F 160965305 PYLXUEJMFSRIGR-MNOVXSKESA-N 267.319 3.327 70 20 CGID CCc1ccccc1NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 161109829 UULRWTROGHLHBR-GOEBONIOSA-N 288.391 3.328 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)c2cc(F)ccc2O)C1 161166348 FOMVFDIUDKKHRN-GFCCVEGCSA-N 279.355 3.430 70 20 CGID C[C@H](NC(=O)NO[C@@H]1CCCCO1)c1ccc(Cl)cc1 161242207 AUFWWWATRQGQTR-GXFFZTMASA-N 298.770 3.158 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)CCCOc1ccc(F)cc1 161440114 NFFATXYUWZSZAT-CHWSQXEVSA-N 279.355 3.384 70 20 CGID O=C(NC1CC1)N[C@@H](c1c(F)cccc1F)C(F)(F)F 161508971 KTELRHRCPJNDAE-JTQLQIEISA-N 294.223 3.030 70 20 CGID C[C@H]1CC(NC(=O)NCC(C)(C)C2CCCC2)C[C@H](C)O1 160224197 WIAXBETXPGKLSF-STQMWFEESA-N 296.455 3.458 70 20 CGID CCOc1cc(Cl)ccc1CNC(=O)NC1CC=CC1 160362742 BVHQRDNDHTYYCL-UHFFFAOYSA-N 294.782 3.257 70 20 CGID O=C([C@H]1CCCCO1)N(Cc1ccccc1)c1ccccn1 160493672 XBSGEEBFIUVUAG-MRXNPFEDSA-N 296.370 3.184 70 20 CGID CN(C(=O)c1cc2ccccc2[nH]1)c1ccc2c(c1)OCO2 160621861 BEKONYQAZSDBPR-UHFFFAOYSA-N 294.310 3.173 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)Nc1cc(C(=O)OC)cs1 160629558 VBXKTWFQXDVQJE-KOLCDFICSA-N 296.392 3.235 70 20 CGID CCn1ccnc1CN1CCC(c2ccccc2)CC1 160789717 LXBAJKQXYXHQMJ-UHFFFAOYSA-N 269.392 3.283 70 20 CGID CC[C@H](C)N(C)CCNCc1cccc2cccnc12 217395800 XUYRRUXOEZLFJZ-AWEZNQCLSA-N 271.408 3.055 70 20 CGID CCC[C@@H]1CCc2c(sc(=O)n2Cc2nccs2)C1 161345634 FGCDTXJEHFNBST-SNVBAGLBSA-N 294.445 3.320 70 20 CGID CCn1cc(NC(=O)[C@@H]2C[C@H]2c2sccc2C)cn1 161447462 GKELPJCNYROMRI-VXGBXAGGSA-N 275.377 3.015 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)c1cc(C)sc1C 160181807 DASFUPJPJNDKJS-CMPLNLGQSA-N 273.467 3.130 70 20 CGID CC1CCN(c2ccc(CN[C@H](C)C(C)C)cn2)CC1 160476603 FEPHKTFGBJHRMT-OAHLLOKOSA-N 275.440 3.452 70 20 CGID CC[C@@H](C)CN(CC)C(=O)c1ccc(N(C)C)cc1F 160600998 LRHDNKIFFVKBRB-GFCCVEGCSA-N 280.387 3.400 70 20 CGID CCc1ncsc1C(=O)NCCCSCC(C)C 160712720 LUKSZXQFFUYZEA-UHFFFAOYSA-N 286.466 3.215 70 20 CGID CC[C@@H](C(=O)N[C@@H]1CCCSC1)c1ccc(F)cc1 160774307 VZZXJBLAYOTHTD-ZIAGYGMSSA-N 281.396 3.331 70 20 CGID CC(C)c1ccc(C(=O)Nc2ccc3[nH]ncc3c2)cn1 160918375 PPYSSPMCRGBOEW-UHFFFAOYSA-N 280.331 3.334 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(-c2nnco2)cc1 160939851 GYIFWYZXSKVAFB-IUODEOHRSA-N 271.320 3.111 70 20 CGID CC[C@@H](CC(=O)N(C)Cc1cccn1C)C(C)C 160997884 UXIVSZCWDPDAPF-ZDUSSCGKSA-N 250.386 3.056 70 20 CGID C[C@@H](C(=O)NCCCNc1ccccc1)c1cccs1 159611290 GQKOUUDANCHANO-CYBMUJFWSA-N 288.416 3.470 70 20 CGID COc1ccnc(NC(=O)[C@@H](c2ccccc2)C2CC2)c1 159486749 NQDCMWZWOSKQOB-INIZCTEOSA-N 282.343 3.223 70 20 CGID C[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)C1CC1 159701296 SWEYIFPFEDYNRI-QWRGUYRKSA-N 265.784 3.433 70 20 CGID Cc1ccc([C@@H]2CCCCN2C(=O)[C@@H]2CCCNC2)cc1 159913348 WJYFXUMTEXSULR-SJORKVTESA-N 286.419 3.048 70 20 CGID Clc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 159654322 GZMWKZTUVKDPQC-ZNMIVQPWSA-N 277.795 3.387 70 20 CGID FC(F)(F)c1nnc(NCCOC2CCCCC2)s1 160165666 NEQQTUZQKPXAAP-UHFFFAOYSA-N 295.330 3.318 70 20 CGID CCCn1nccc1CNCCc1ccc(F)cc1C 160178772 HJALUHVHROHHHL-UHFFFAOYSA-N 275.371 3.073 70 20 CGID CC[C@@H](N[C@H](C)C(=O)NCC(C)C)c1ccc(F)cc1F 161014861 CIDJTGXCMYSNEN-IAQYHMDHSA-N 298.377 3.166 70 20 CGID C[C@@H](SCc1nncn1C)c1ccc(Cl)cc1 161041716 TVDHFGUZHUZXOU-SECBINFHSA-N 267.785 3.463 70 20 CGID COC(=O)c1cccc(CNc2ncccc2Cl)c1 161235909 KOMFKRCQOZHZLM-UHFFFAOYSA-N 276.723 3.134 70 20 CGID CCc1ncc(NC(=O)[C@H](CC)c2ccc(F)cc2)cn1 161311384 LCBMTIWOHHDALA-CQSZACIVSA-N 287.338 3.310 70 20 CGID COc1ccc(OC)c([C@H](C)N[C@H](C)C2CCOCC2)c1 160012005 OQMSDBNEAOQKSZ-OLZOCXBDSA-N 293.407 3.170 70 20 CGID CN(C(=O)c1cccc2cc[nH]c12)c1ccc2c(c1)OCO2 160372958 WMUDWCRUUKVOJK-UHFFFAOYSA-N 294.310 3.173 70 20 CGID CSC[C@H]1CCCN1C(=O)C[C@@H](C)c1c(C)noc1C 160530665 SVAJIANZWJISGK-ZWNOBZJWSA-N 296.436 3.139 70 20 CGID C[C@@H](OC1CCCCCC1)C(=O)Nc1cccc(F)n1 160622671 MHXUVUOSAPVVLV-LLVKDONJSA-N 280.343 3.287 70 20 CGID CCCCS[C@@H](C)C(=O)NCC1(C2CC2)CC1 159802377 VCYBMHFDCITCGF-NSHDSACASA-N 255.427 3.215 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(C)n(C(C)(C)C)n1 159810734 WTTMREVVCJEQEC-OLZOCXBDSA-N 277.412 3.255 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCc1ccco1 159690270 YROHLFKUKIONKG-OLZOCXBDSA-N 275.373 3.112 70 20 CGID Cc1cccc2sc(NC(=O)[C@H]3CCCCO3)nc12 159762741 HLMWXCXBZKDMCA-SNVBAGLBSA-N 276.361 3.112 70 20 CGID CC(C)COC[C@H](O)CNC(C)(C)c1ccc(Cl)cc1 159590856 VORMEBQPLPVUDS-OAHLLOKOSA-N 299.842 3.198 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2cnc(C)s2)n1 160078845 XIUQKYXLPWNBLB-OAHLLOKOSA-N 273.405 3.492 70 20 CGID C[C@H](Nc1nnc(C(F)(F)F)s1)c1ccccn1 160151443 RDJFWVJHFWNJQE-LURJTMIESA-N 274.271 3.125 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237809 MZQKWZXASZHQSV-GHMZBOCLSA-N 299.367 3.110 70 20 CGID CC(C)(C)OC(=O)N1CC[C@@H](c2ccc(O)cc2)C1 218509682 WQUOIEJDDVWIAZ-GFCCVEGCSA-N 263.337 3.117 70 20 CGID CC[C@H](CC1CCCC1)C(=O)N[C@@H](CO)CC(C)C 161080160 HLTRMHFTTNROQK-HUUCEWRRSA-N 269.429 3.116 70 20 CGID CO[C@@H](C)C(=O)N1CCCC[C@H]1CCCc1ccccc1 161169513 QIWMFIFNFQNLMK-RDJZCZTQSA-N 289.419 3.425 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CC1CCOCC1 161238113 SDKIZCSVZNDIJO-GJZGRUSLSA-N 267.413 3.230 70 20 CGID CO[C@@H](C(=O)N1c2ccccc2C[C@@H]1C)c1ccccc1 161258227 GWSCDSFBBXAIKO-SUMWQHHRSA-N 281.355 3.352 70 20 CGID CS[C@@H](C)CC(=O)N(C)[C@H](C)c1cccs1 160017625 XAXKDIQNJAUUQZ-VHSXEESVSA-N 257.424 3.409 70 20 CGID COc1ccc(NC(=O)NC2C[C@@H](C)O[C@H](C)C2)c(C)c1 160371544 MJMCQUUDOFTCFW-VXGBXAGGSA-N 292.379 3.081 70 20 CGID CCSc1ccc([C@@H](C)NCc2n[nH]c(CC)n2)cc1 160410508 MZKRKZXTKPWAEC-LLVKDONJSA-N 290.436 3.330 70 20 CGID CC[C@@H](NCCCCc1nc(C)cs1)c1cnn(C)c1 160643514 FTADXGYYKBWIHS-CQSZACIVSA-N 292.452 3.249 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1csc(COC)n1 160983634 LCCWHLWGYSHOAZ-AAEUAGOBSA-N 296.436 3.330 70 20 CGID c1ccc(C[C@@H](N[C@H]2CCCSC2)C2CC2)cc1 159529619 VHGHKTWWTCYACN-JKSUJKDBSA-N 261.434 3.493 70 20 CGID Cc1cccc(C(=O)Nc2n[nH]c3ccccc23)c1F 161442990 LCEBEYCGGQYJIC-UHFFFAOYSA-N 269.279 3.263 70 20 CGID Cc1ccc(CCNC(=O)N[C@@H]2CCCC[C@H]2C)cc1 217307835 IOLWPNDQDLZWKP-GDBMZVCRSA-N 274.408 3.415 70 20 CGID C[C@H]1CC/C(=C\C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 776368141 OHMOCSZYZDGJIM-SPQRFVMMSA-N 297.351 3.030 70 20 CGID Cc1ccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c(F)c1 161035549 WJUPYKQVDGRYDQ-IUODEOHRSA-N 292.354 3.213 70 20 CGID CC[C@@H](NCc1ccc(C)nc1)c1ccc2c(c1)OCCO2 161280158 NRLMZPAJHWRUPC-MRXNPFEDSA-N 298.386 3.402 70 20 CGID O=C(c1csc([C@H]2CCCO2)n1)N1CCCCCCC1 161290122 GLGSPSAZDFJXQP-CYBMUJFWSA-N 294.420 3.401 70 20 CGID CCCn1nccc1CNc1ccc(OC)c(OCC)c1 160060365 ZTJILPQPRWGDIC-UHFFFAOYSA-N 289.379 3.313 70 20 CGID CC[C@H](NC(=O)C1CCCCC1)c1c(C)noc1C 160277464 HWYNANDDQVLELQ-ZDUSSCGKSA-N 264.369 3.439 70 20 CGID CSC[C@H](CCO)N[C@H]1CC[C@H](C)c2ccccc21 160325950 JLNPAWSQCBBJRN-XEZPLFJOSA-N 279.449 3.329 70 20 CGID C/C=C(\C=C\C(=O)NC[C@@H](O)c1ccccc1C)CC 160460754 QHTRUARFRKOMSO-VNRJZUDGSA-N 273.376 3.057 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cc(C)on1 160876498 WRSGILJEIPXSDU-DGCLKSJQSA-N 250.342 3.024 70 20 CGID CCNC(=O)[C@@H](CC)Cc1ccccc1Br 160892464 KFDWKPQMWWSBEP-JTQLQIEISA-N 284.197 3.154 70 20 CGID O=C(O[C@H](c1ccccn1)C(F)(F)F)C1CCC1 159939668 CPAUVQVNKAXGBS-SNVBAGLBSA-N 259.227 3.028 70 20 CGID CCc1ccc([C@H](CNC(=O)C2=CCCC2)N(C)C)cc1 159653304 VTWZDDYMENGFJM-KRWDZBQOSA-N 286.419 3.078 70 20 CGID CC[C@H](C(=O)NCC(C)(C)c1ccc(Cl)cc1)N(C)C 159387295 WYNOCZGMPCJLTI-CQSZACIVSA-N 296.842 3.074 70 20 CGID CCCCO[C@H]1C[C@H](N[C@@H](C)c2cnccn2)C1(C)C 159779601 VGDHVDUZIMSQFN-QEJZJMRPSA-N 277.412 3.111 70 20 CGID CCN1CCC[C@H]1CN[C@H](c1ccccc1)C(C)C 217876260 HRRWYGIRLRYLBF-IRXDYDNUSA-N 260.425 3.458 70 20 CGID CC[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OC 159517272 GDLOTIQARIQGBP-JOYOIKCWSA-N 289.297 3.308 70 20 CGID CCC[C@@H](O)CNCc1ccc(F)c(C(F)(F)F)c1 160149142 KTCWSIAOBXIIBA-SNVBAGLBSA-N 279.277 3.095 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(Cl)ccn1 159578399 GNPWZHJBNOSOMV-ONGXEEELSA-N 252.745 3.044 70 20 CGID COc1ccc2c(c1)[C@H](N[C@H]1CCC[C@H](N(C)C)C1)CC2 161040800 LVJSSZIPJCKBBH-RLFYNMQTSA-N 288.435 3.145 70 20 CGID CC[C@H]1CCC[C@H](NC(=O)NCCc2ccncc2C)C1 161463294 YNMNERWEGVBQLM-HOCLYGCPSA-N 289.423 3.201 70 20 CGID C[C@H]1CCC[C@H](C(=O)N(Cc2ccncc2)C2CC2)C1 161473902 GCJAKUALEDARLH-ZFWWWQNUSA-N 272.392 3.399 70 20 CGID O=C(CC[C@@H]1CCCO1)N[C@H]1CCCc2sccc21 160139125 RKJMZYZETKVFEV-AAEUAGOBSA-N 279.405 3.201 70 20 CGID O=C(N[C@H]1CCSc2ccc(F)cc21)[C@H]1CCCCO1 160290924 RDFYBCDABKCHLD-QWHCGFSZSA-N 295.379 3.048 70 20 CGID CC(C)(O)CN[C@H]1CCC[C@@H]1CCc1ccccc1 160652388 CIKQNZHMZQZUCZ-CVEARBPZSA-N 261.409 3.148 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1cccc2[nH]ccc12 159403788 HWBRXVVPEWYLKQ-ZDUSSCGKSA-N 298.386 3.390 70 20 CGID CCc1ccc(CN(CCn2ccnc2)C2CC2)cc1 159742366 SBOPEGTXMGARGE-UHFFFAOYSA-N 269.392 3.110 70 20 CGID C[C@@H](Cc1cccc(F)c1)C(=O)NCC1(C2CC2)CC1 159960761 QPTZERCAPHRXJI-LBPRGKRZSA-N 275.367 3.311 70 20 CGID c1ccc([C@@H](N[C@@H]2CCSC2)c2ccccn2)cc1 218593108 KXSPKDPQBCQSNL-GDBMZVCRSA-N 270.401 3.266 70 20 CGID Cc1ccc(O)c(C(=O)N2CC=C(C(F)(F)F)CC2)c1 160600624 NWDGEHIURLUQHM-UHFFFAOYSA-N 285.265 3.035 70 20 CGID c1cc2c(c(NCc3nnc4n3CCCC4)c1)CCCC2 217317473 SQCGDWHKOPAMEA-UHFFFAOYSA-N 282.391 3.105 70 20 CGID CC(=O)NC1CCC(Nc2cccc(-c3cnco3)c2)CC1 161073117 FEMHUUPWSZDGQI-UHFFFAOYSA-N 299.374 3.201 70 20 CGID COCCCNC(=O)[C@@H](C)SCc1c(C)cccc1C 161381082 RFEVOPFUTXKBSP-CQSZACIVSA-N 295.448 3.078 70 20 CGID C[C@@H](NCC1(CO)CCCC1)c1ccccc1OC(F)F 160083681 ZCINWXLAWHQOTE-GFCCVEGCSA-N 299.361 3.491 70 20 CGID Cc1c(C(=O)N2CC[C@@H](N)C2)oc2c1ccc1ccccc12 160222669 GMVASHYEONGZHK-CYBMUJFWSA-N 294.354 3.068 70 20 CGID CCOc1cncc(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160547992 BWPXWXYUXBCMOV-GJZGRUSLSA-N 299.374 3.208 70 20 CGID CC(C)C[C@@H](CO)NC(=O)c1ccc(C(C)(C)C)s1 160671501 VTPHNFRJJVSMMD-NSHDSACASA-N 283.437 3.182 70 20 CGID CC1(C)C[C@H](Nc2nc3cc(F)ccc3o2)CCO1 160715932 RXRBVVMIHCUYRE-SNVBAGLBSA-N 264.300 3.336 70 20 CGID CC[C@H](C)N(C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 160771975 DVCRLSATPGITLI-BPUTZDHNSA-N 290.407 3.347 70 20 CGID C[C@H](C(=O)NCCCNc1ccccc1)c1ccsc1 159611582 MLSBPZPCLCSEOX-ZDUSSCGKSA-N 288.416 3.470 70 20 CGID CCOc1ccccc1NC(=O)N(C)[C@@H]1CCSC1 159454407 DQIUWFVZAKTNLT-LLVKDONJSA-N 280.393 3.055 70 20 CGID CN(C[C@@H]1CCC[C@@H]1O)[C@@H]1CCCc2ccc(F)cc21 159701701 FKXVHMNIZMOJKT-XKQJLSEDSA-N 277.383 3.296 70 20 CGID NC(=O)CC1CCN(Cc2ccc(-c3ccccc3)o2)CC1 159717672 ZPMSVLDIPIOOMR-UHFFFAOYSA-N 298.386 3.034 70 20 CGID Cc1nc2ccccn2c1CN1[C@@H](C)CCC[C@H]1C 159774695 FMNUPIAZWZPQGI-BETUJISGSA-N 257.381 3.406 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)C(=O)NC(C)(C)CC 160587534 JIYAGYNTDVSSEU-OLZOCXBDSA-N 256.434 3.048 70 20 CGID C[C@@H]1C[C@@H]1c1ccc(CNC[C@@H](O)c2ccccc2)o1 217634848 WGWANKXRIJLYKD-UHOFOFEASA-N 271.360 3.226 70 20 CGID CCCCS[C@H](C)C(=O)Nc1ccc(OC)c(N)c1 161124600 GNZPRLOUSKZWEL-SNVBAGLBSA-N 282.409 3.138 70 20 CGID CC[C@H](NCc1cccc(C(=O)N[C@H](C)CC)c1)C1CC1 161136329 VILGSRIAANAANN-DYVFJYSZSA-N 288.435 3.493 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H]1CCCc2nc(C)sc21 161197180 IKQZXNBDXKDNEE-ZIAGYGMSSA-N 293.480 3.293 70 20 CGID Cc1cc(NC(=O)Nc2ccn(C)n2)ccc1C(F)(F)F 161324524 JMYSSYBXAUKMKF-UHFFFAOYSA-N 298.268 3.391 70 20 CGID CC[C@@H](NC(=O)c1cc(C)ncn1)c1cccc(Cl)c1 161481767 APVFSBYXMUYULU-CYBMUJFWSA-N 289.766 3.320 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)N1CCCCC1 160003854 ODOXSWYAHXWCTK-GFCCVEGCSA-N 296.436 3.180 70 20 CGID CCCn1nccc1CNc1ccc(F)c(NC(C)=O)c1 160094364 BDFPEAAYTJVTIZ-UHFFFAOYSA-N 290.342 3.003 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1cnn(-c2ccccc2)c1 160219036 HIQJYHJVYDXSFQ-AEFFLSMTSA-N 297.402 3.267 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N1CCN(c2cccc(C)c2)CC1 160254549 IKCDWOVCOCOLMH-AEFFLSMTSA-N 286.419 3.080 70 20 CGID C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@@H]1CCCCO1 160593145 LZTRHUSLKIQCRB-YGRLFVJLSA-N 283.318 3.053 70 20 CGID C[C@@H](O)C[C@@H](C)CNC(=O)CC[C@@H](C)c1ccccc1 160685442 NQILZUHXTMPYLC-RBSFLKMASA-N 277.408 3.094 70 20 CGID CC(C)c1ccc(C(=O)NCc2cccc(F)c2)cn1 160948855 MDQZDYBHLIKRRC-UHFFFAOYSA-N 272.323 3.274 70 20 CGID CCc1ccc([C@@H](C)CC(=O)N[C@@H](CO)CC(C)C)cc1 160990085 QJNLYMGBMPYKHA-WMLDXEAASA-N 291.435 3.266 70 20 CGID CC[C@@H](C)OCC(=O)N1CCC[C@H]1C1CCCCC1 159451182 VOIZVERIBQZIOK-HIFRSBDPSA-N 267.413 3.373 70 20 CGID COC[C@@H](Nc1nc(C(C)(C)C)ns1)c1ccco1 159860570 LGCBNZQTOKLZEG-SECBINFHSA-N 281.381 3.228 70 20 CGID CC[C@H](NCCCN1CCCC1=O)c1ccc(C)cc1 159479546 GAWYPWKHLLAQOY-INIZCTEOSA-N 274.408 3.048 70 20 CGID Cc1cc(NC(=O)[C@H]2C[C@H]2c2sccc2C)no1 159918210 BLYIEQLPNFMPIC-ZJUUUORDSA-N 262.334 3.095 70 20 CGID CCSc1ccc([C@@H](C)NCc2nc(C)no2)cc1 159370413 LFKSPMCPNKFXCA-SNVBAGLBSA-N 277.393 3.341 70 20 CGID CCc1ccc(CNCc2cn3ccccc3n2)s1 218215236 BUHPSEJKMZPVOB-UHFFFAOYSA-N 271.389 3.248 70 20 CGID CCc1nsc(N[C@H]2CCCc3cc(N)ccc32)n1 159514412 GIJANNWALVVUOR-LBPRGKRZSA-N 274.393 3.172 70 20 CGID C[C@@H]1CCCC[C@@H]1NC(=O)c1c[nH]nc1-c1ccccc1 217141072 ZXNLQWGOVFFGPN-DOMZBBRYSA-N 283.375 3.385 70 20 CGID CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Cl)nc1C 160653900 NJHCHGVNBFIWKD-NWDGAFQWSA-N 298.839 3.447 70 20 CGID CC[C@@H](C)N(C)CCNc1ncnc2sc(C)c(C)c12 217366317 SSZPMYHCQMIXRK-SNVBAGLBSA-N 292.452 3.450 70 20 CGID C[C@H]1CN(C)[C@H](C)C[C@H]1NCC[C@@H](C)c1ccccc1 217472243 DQKOMGOZEFGIEE-KYHPRHEASA-N 274.452 3.499 70 20 CGID CC(C)NCCC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F 161043134 FCMYFEHSUUOOIN-CZUORRHYSA-N 292.398 3.123 70 20 CGID CCc1ccccc1NC(=O)N[C@H]1CCO[C@H](C2CC2)C1 161109609 UULRWTROGHLHBR-HOCLYGCPSA-N 288.391 3.328 70 20 CGID COc1ccc(NC(=O)C(C)(C)CC(C)C)cc1N 161142786 IYNBGMGHDNJPSW-UHFFFAOYSA-N 264.369 3.288 70 20 CGID CC[C@H](c1ccccc1)S(=O)(=O)[C@H](C)c1nnc(C)o1 160433329 IMHSIKXCIIEOQC-ZWNOBZJWSA-N 294.376 3.005 70 20 CGID CC[C@@H](CNC(=O)C1=C(C)OCCC1)c1ccccc1 160703612 IKZNPPLUGRGLQM-AWEZNQCLSA-N 273.376 3.381 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cc(C)no1 160780800 PQXFVVSYHRYLKL-VXGBXAGGSA-N 250.342 3.024 70 20 CGID COCCN(CC(C)C)c1nc2cc(F)ccc2o1 160918584 PGSFUXVGAYPESD-UHFFFAOYSA-N 266.316 3.076 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)Cc1ccc(F)c(F)c1 160936738 GAOCNELRDZJVJU-ABAIWWIYSA-N 267.319 3.359 70 20 CGID CC(C)c1cc(C(=O)N2c3ccccc3OC[C@H]2C)no1 159604934 PLAGSUMQZAIOEX-LLVKDONJSA-N 286.331 3.226 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H](C)C2CCOCC2)C1 159457613 VJUIPOWYZPMHNC-CFVMTHIKSA-N 271.470 3.455 70 20 CGID CC(C)CCO[C@@H](C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159459084 CANRVBCEFRVBFX-GJZGRUSLSA-N 297.439 3.046 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccc(Cl)cc1 159943233 KEAIPKPPLSLCMB-GWCFXTLKSA-N 267.756 3.086 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)NC(C)(C)C 159988369 KCYVKDCQKXSRHG-JTQLQIEISA-N 284.425 3.082 70 20 CGID CNc1ccc(C(F)(F)F)cc1C(=O)NC[C@H]1C[C@H]1C 160089950 GWTGQGMQTMMMAU-RKDXNWHRSA-N 286.297 3.133 70 20 CGID c1ccc2c(CN[C@@H]3CCN4CCCC[C@H]34)coc2c1 161076059 NVGGOEVAHMHQGO-HZPDHXFCSA-N 270.376 3.149 70 20 CGID Cc1ccc([C@H](C)N[C@H]2CCC[C@H](N(C)C)C2)o1 161127254 BMKJRCPKYKPEMF-IHRRRGAJSA-N 250.386 3.111 70 20 CGID CC(C)(C)c1nsc(NCCOCc2ccccc2)n1 159804168 SZUGFZHZIFKXOD-UHFFFAOYSA-N 291.420 3.464 70 20 CGID CC[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc(F)cc1 217688703 QXHIAKIVLZHVSM-ULQDDVLXSA-N 276.399 3.493 70 20 CGID Cc1cccc(C)c1OCCCN[C@H](C)C1CCOCC1 161238633 OKRGGNLNKVARKT-MRXNPFEDSA-N 291.435 3.477 70 20 CGID CCc1ncc(C(=O)N[C@H](CC)c2c(C)noc2C)s1 160024075 YHIFCKKJHIJARD-SNVBAGLBSA-N 293.392 3.191 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc2ccccc2o1 160044413 OZTNLSFQEBWMMI-UHFFFAOYSA-N 255.317 3.353 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@H]1c1ccc(F)cc1 160200333 DUVBFMGHQDJVSU-LSDHHAIUSA-N 273.351 3.236 70 20 CGID CC[C@H](NCCOc1c(C)cccc1C)[C@@H]1CCOC1 160277724 MPUCYLAILQVNBC-CVEARBPZSA-N 277.408 3.087 70 20 CGID O=C(N[C@H]1CCO[C@H](C2CC2)C1)N(C1CCCC1)C1CC1 160347305 UQHVDKBIJJWXDA-BBRMVZONSA-N 292.423 3.061 70 20 CGID CC[C@@H](C)OCC(=O)N[C@H](c1ccccc1)C(F)(F)F 160478908 XZEUTJQYCAORGS-ZWNOBZJWSA-N 289.297 3.221 70 20 CGID CC[C@H](NC(=O)[C@@H](C)OCCC(C)C)c1c(C)noc1C 160600344 BZHUAHZQWXJQLQ-KGLIPLIRSA-N 296.411 3.310 70 20 CGID O=[S@](Cc1nccs1)c1ccc(Cl)cc1 160627255 IKUIXLSDDFBUBB-HNNXBMFYSA-N 257.767 3.104 70 20 CGID O=C(Nc1cccc(F)n1)[C@@H](c1ccccc1)C1CC1 160766428 QCBDGCVWZKGIME-HNNXBMFYSA-N 270.307 3.353 70 20 CGID CCCCOc1cccc(CN[C@H](C)[C@@H]2CCOC2)c1 160817750 RRMQXGJXUXDUFP-GDBMZVCRSA-N 277.408 3.380 70 20 CGID C[C@H](SCCCCS(C)(=O)=O)c1ccccc1F 160931120 NJZDCQSYRSHEEB-NSHDSACASA-N 290.425 3.445 70 20 CGID O=C(CCN1CC[C@@H]2CCCC[C@@H]21)N1CCc2ccccc21 159586501 XWGWHAQYFWDLPW-RDJZCZTQSA-N 298.430 3.230 70 20 CGID Cc1cc(C)c(CN[C@H]2CCN3CCCC[C@@H]23)cc1C 218126977 ODXKAJDQIRXZHV-ROUUACIJSA-N 272.436 3.328 70 20 CGID C[C@H](CNCc1cc(F)cc(F)c1)CN1CCCCC1 160400735 GWJFXZMLAAMFIP-CYBMUJFWSA-N 282.378 3.176 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@H](C)C(=O)OC(C)(C)C 161066028 SYSCUEGTAWLGMD-SNVBAGLBSA-N 297.782 3.108 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@@H](C)CSC 161130091 UQHXPOBKNBPZKA-XQQFMLRXSA-N 257.443 3.413 70 20 CGID CCN(CC(C)(C)O)C(=O)CC1CCC(C)(C)CC1 160110171 MSIBLRYPKJNDQF-UHFFFAOYSA-N 269.429 3.212 70 20 CGID O=C(Nc1ccccc1OC(F)(F)F)[C@@H]1CCCCO1 160304550 MVYWNMYWHSPBSO-NSHDSACASA-N 289.253 3.093 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@@H]1CCc2c(OC)cccc21 159887166 NFUBKOAQLRWTKX-SWLSCSKDSA-N 291.391 3.004 70 20 CGID CC1(C)CN(c2nc(C(C)(C)C)ns2)CCS1 159889250 CDJQUBTWWWTSPF-UHFFFAOYSA-N 271.455 3.167 70 20 CGID Cc1ccsc1C(=O)N[C@H]1CCOC2(CCCC2)C1 159923141 RBYVVCAUEHCKEQ-LBPRGKRZSA-N 279.405 3.278 70 20 CGID OCCc1ccc(NCc2cccc3c2NCCC3)cc1 159390887 CQQDDNIJGMZBIV-UHFFFAOYSA-N 282.387 3.192 70 20 CGID Cc1cccc([C@H](C)NCc2c(C)nn(C)c2C)c1 160204500 GSPCNEIQAKJGBN-LBPRGKRZSA-N 257.381 3.196 70 20 CGID CC[C@H](C)[C@H](C)NC(=O)c1ccc(N(C)C)cc1F 161056415 MFBFRNYHULDZER-QWRGUYRKSA-N 266.360 3.056 70 20 CGID Cc1ccn2c(CN(C)Cc3ccc(F)cc3)cnc2c1 161145602 XANZNKGOICABRT-UHFFFAOYSA-N 283.350 3.414 70 20 CGID CS[C@H](C)CNC(=O)[C@H](C)Cc1ccc(Cl)cc1 161374732 QSEBOPIJLRQZTD-GHMZBOCLSA-N 285.840 3.386 70 20 CGID C[C@H]1OCC[C@@H]1Sc1nc(C(C)(C)C)ns1 160099452 PTLSEMRBVUVHKH-SFYZADRCSA-N 258.412 3.105 70 20 CGID CCCCCNC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 160176896 HNJCJGSNHYBZJU-JSGCOSHPSA-N 296.436 3.410 70 20 CGID CCOC[C@@H]1CCN(C(=O)C[C@@H]2CCCCC2(C)C)C1 160390494 SUCQXAOYNLYNTM-CABCVRRESA-N 281.440 3.478 70 20 CGID CC(C)N(C(=O)Cc1cc(F)c(F)cc1F)C1CCC1 160627476 HUBCDRVNNZDAJB-UHFFFAOYSA-N 285.309 3.436 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](CC)C2CC2)c1 160635372 HTKVQZMFZTXKSH-MRXNPFEDSA-N 274.408 3.105 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@@H](C)Cc1ccc(Cl)cc1 160798364 BHCCUNCIYDEWAI-WFASDCNBSA-N 297.826 3.042 70 20 CGID Cc1cc2cc(NC(=O)[C@H]3CCC(=O)C[C@@H]3C)ccc2[nH]1 159851885 OYAKVFKAPNIEBS-BONVTDFDSA-N 284.359 3.420 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2cn3ccccc3n2)n1 159885078 IQQMMLMEJFQSBF-QGZVFWFLSA-N 292.386 3.375 70 20 CGID Cn1ncc2c(NC3CC(C)(C)CC(C)(C)C3)ncnc21 159386192 MLSZXBPPWHXCNL-UHFFFAOYSA-N 287.411 3.380 70 20 CGID COc1ccc(C)cc1N[C@@H](C)CCn1cccn1 159390884 KHTJFHKUPLDKHL-ZDUSSCGKSA-N 259.353 3.091 70 20 CGID CN(Cc1nccn1Cc1ccccc1)c1cccc(F)n1 159728199 ZDEBLCONSMZUMJ-UHFFFAOYSA-N 296.349 3.102 70 20 CGID CCOC(CCN[C@H](C)c1ccc(C)cc1)OCC 159917709 ILQDGERVUFKTMS-CQSZACIVSA-N 265.397 3.435 70 20 CGID CCCn1nccc1CNc1cccc2ccncc12 160179756 DKALAVVNZDSINF-UHFFFAOYSA-N 266.348 3.453 70 20 CGID C[C@H](CO)SCc1ccc(F)cc1Br 160713855 AHUCYWLHNQMBMX-SSDOTTSWSA-N 279.174 3.202 70 20 CGID O[C@@H](C[C@@H]1CCCN1c1ccccn1)c1ccc(F)cc1 161146371 YXFGQSIKBAGVGY-HOTGVXAUSA-N 286.350 3.313 70 20 CGID CN(C(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)C1CCC1 161146430 PWNAPEBCJAQRFW-CPWXYTRJSA-N 265.372 3.306 70 20 CGID CC[C@H](C)OCC(=O)N[C@@H]1CCCc2sccc21 160125228 WHIPVJWPVCTWDZ-CMPLNLGQSA-N 267.394 3.057 70 20 CGID Cc1cccc2nc(CN[C@@H]3CC(C)(C)OC3(C)C)cn12 160338206 KHIDLMIOBKCTCZ-CQSZACIVSA-N 287.407 3.078 70 20 CGID CCc1noc(C)c1CS(=O)(=O)c1ccccc1Cl 160336963 WKUPGUXBBAUFCK-UHFFFAOYSA-N 299.779 3.173 70 20 CGID CC(C)(CO)CCCNC(=O)C(C)(C)c1ccc(F)cc1 160371102 XQROSGULGAOOAT-UHFFFAOYSA-N 295.398 3.018 70 20 CGID Brc1cncc(CNCc2ccsc2)c1 160575699 BLLJZPXUGYRFRI-UHFFFAOYSA-N 283.194 3.195 70 20 CGID Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cncnc2C)c1 160674545 IWMUMKABPQXLHQ-KRWDZBQOSA-N 295.386 3.379 70 20 CGID Cc1ccc([C@H](C)NCC[S@@](=O)c2ccccc2)cc1 160789500 GMLBGOZYYAODNF-YWZLYKJASA-N 287.428 3.453 70 20 CGID CC[C@@H](C)[C@H](C)NC(=O)N1CCC(CCCN(C)C)CC1 160932191 KYWHOEMYZXTCMS-CABCVRRESA-N 297.487 3.184 70 20 CGID CCOc1ccccc1N(C)CC(=O)N(C)c1ccccc1 159422537 UWDSSANPXXZKFU-UHFFFAOYSA-N 298.386 3.185 70 20 CGID COCc1ccccc1NC(=O)N[C@H](C)CC(C)C 159873415 XTBMBJAIBQXNQX-GFCCVEGCSA-N 264.369 3.389 70 20 CGID CCC1(C(=O)N[C@@H]2CCOC3(CCCC3)C2)CCC1 159905688 VAONVYNWVHQZIB-CYBMUJFWSA-N 265.397 3.175 70 20 CGID CCC1(CNC(=O)NC[C@@H](C)c2c(C)noc2C)CCC1 159549713 KYFRXZBUHZRXSZ-LLVKDONJSA-N 293.411 3.274 70 20 CGID C[C@H]1CCN(C(=O)Nc2nnc(C(C)(C)C)s2)C[C@H]1C 159763415 SBTRVNHOPVIIPM-VHSXEESVSA-N 296.440 3.345 70 20 CGID Oc1ccc(CCNCc2cccc3c2NCCC3)cc1 159390603 LUTBRJKWGXDUEV-UHFFFAOYSA-N 282.387 3.083 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cc(F)c(F)c(F)c1 161466322 XAKTYKFTLUBRIP-HTQZYQBOSA-N 257.255 3.117 70 20 CGID Cc1cc(C(=O)N(C)CC(F)F)ccc1Br 160257309 MAJARLIUZOOLFI-UHFFFAOYSA-N 292.123 3.095 70 20 CGID CCC(CC)n1nccc1C(=O)Nc1cccc2cn[nH]c12 161101741 XNERAQGGLGRJEE-UHFFFAOYSA-N 297.362 3.373 70 20 CGID CSc1ccc(C(=O)N(C)Cc2cccn2C)cc1 160852413 UNIICDIBLNYFIE-UHFFFAOYSA-N 274.389 3.019 70 20 CGID CSc1cc(C(=O)NCc2c(C)noc2C)ccc1F 160966648 UHOUZZFPWAQFKP-UHFFFAOYSA-N 294.351 3.082 70 20 CGID COC(=O)[C@H](C)CN(C(=O)C1CCC(C)(C)CC1)C1CC1 159835002 FUGDBDJITZYAPO-GFCCVEGCSA-N 295.423 3.003 70 20 CGID CCOC(CN[C@@H]1C[C@H]2CC[C@@]1(C)C2(C)C)OCC 218525293 FYHZMKWZXKJAPJ-XJKCOSOUSA-N 269.429 3.190 70 20 CGID C[C@H]1CC(Nc2nc(C(C)(C)C)ns2)C[C@H](C)O1 160184453 IURBSAPBZYGMDY-IUCAKERBSA-N 269.414 3.204 70 20 CGID CCc1cc(O)nc(CN2CCC[C@@H]2c2cccs2)n1 160549030 KPAHWNFCLSDQOI-GFCCVEGCSA-N 289.404 3.143 70 20 CGID CC(C)[C@H](CNCc1cccc2cc[nH]c12)N1CCCC1 218100556 IMEVKEJHDOLXCB-KRWDZBQOSA-N 285.435 3.378 70 20 CGID Cc1cccc(CNC(=O)Nc2cc(Cl)ccn2)c1 217314580 ZRUNBKFJRADQHV-UHFFFAOYSA-N 275.739 3.365 70 20 CGID CCOCCC1(CNC(=O)/C=C/c2ccc(CC)o2)CC1 161333667 RSYUUIAAXGDUGL-BQYQJAHWSA-N 291.391 3.178 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)c2ccsc2)n1 161347363 YUZPCGMXXBYIGQ-UHFFFAOYSA-N 298.371 3.348 70 20 CGID CC[C@H](C(=O)N1CCOC2(CCC2)C1)c1ccc(F)cc1 161455622 FBNJZWLJNTYZCR-HNNXBMFYSA-N 291.366 3.101 70 20 CGID Cc1ccc(OCC(=O)N2[C@@H](C)CC[C@H]2C)cc1C 161405543 GTRHCWZDNPLQCL-OKILXGFUSA-N 261.365 3.082 70 20 CGID Cc1ccsc1CCCC(=O)Nc1ccncc1O 161503405 IYWGNWOVZNKNKB-UHFFFAOYSA-N 276.361 3.119 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1cccc(Oc2cnccn2)c1 161509146 SLQXCNLIFDHDRY-CHWSQXEVSA-N 297.358 3.282 70 20 CGID Cc1cscc1C(=O)N[C@@H]1CCOC2(CCCC2)C1 160012676 HFCNOSQMNNPWJV-GFCCVEGCSA-N 279.405 3.278 70 20 CGID C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc2[nH]ccc2c1 160038403 QEUBKFZWEVQIKH-CHWSQXEVSA-N 286.375 3.336 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)C(C)(C)c1ccccc1 160172936 QBJHUOFIIGXGAC-DZGCQCFKSA-N 281.465 3.056 70 20 CGID CCOCCC1(CNC(=O)N[C@@H]2CCCCC2(C)C)CC1 160262815 KMOJRZDZQCTGFG-CQSZACIVSA-N 296.455 3.461 70 20 CGID C[C@@H]1CC[C@H](CC(=O)Nc2ccnn2C(C)(C)C)C1 160581562 ZFQNSPMAVSXGOK-NEPJUHHUSA-N 263.385 3.403 70 20 CGID CCN(C(=O)N[C@H]1CCN(C2CCCC2)C1)[C@@H](C)C(C)C 160901761 DBUKXXIQKBQLMS-GJZGRUSLSA-N 295.471 3.079 70 20 CGID C[C@@H]1CCC[C@@H](NC(=O)N(CCN(C)C)C2CCCC2)C1 160916811 FIOHJXPGPGGIQJ-HUUCEWRRSA-N 295.471 3.081 70 20 CGID CCOCCC1(C(=O)NCc2cccc(C)c2)CCC1 160965801 VREURLCHFYEHRC-UHFFFAOYSA-N 275.392 3.208 70 20 CGID CC(C)(C)NCCNC(=O)c1ccc(C(C)(C)C)s1 159804707 YSZCMORYVMLDOL-UHFFFAOYSA-N 282.453 3.164 70 20 CGID O=C(CC1CCCC1)N[C@H]1CCOC2(CCCC2)C1 159674644 SPUQRJNXWHWTDS-AWEZNQCLSA-N 265.397 3.175 70 20 CGID C[C@H]1CN(c2nc(C(C)(C)C)ns2)C[C@@H](C)S1 159695332 WTCLWZNHGOXGAJ-DTORHVGOSA-N 271.455 3.166 70 20 CGID CCCCO[C@@H]1C[C@@H](N[C@@H](C)c2cnn(C)c2)C1(C)C 159781491 PNXUNUFADUYYCB-NWANDNLSSA-N 279.428 3.055 70 20 CGID C[C@@H](CC(=O)NCC1(C2CC2)CC1)c1ccccc1 159999591 KHZOGYNLDWTVEH-ZDUSSCGKSA-N 257.377 3.487 70 20 CGID CC(C)S(=O)(=O)CCCN1CC[C@@H](C)c2ccccc21 160848280 SQANZRYWLDBZNF-CQSZACIVSA-N 295.448 3.214 70 20 CGID CCOCCC1(C(=O)Nc2ccc(F)cc2)CCC1 161062734 ATTKKYNFRBGQAR-UHFFFAOYSA-N 265.328 3.361 70 20 CGID CCc1noc(C)c1CS(=O)(=O)c1cc(C)ccc1C 160343124 AHXYPEHXEHBCQZ-UHFFFAOYSA-N 293.388 3.136 70 20 CGID C[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1cnc2ccccn12 160478229 MGYAVPUBIZKCCE-FMKPAKJESA-N 269.392 3.487 70 20 CGID CSc1cc(C(=O)OCc2nc(C)sc2C)ccn1 160642602 CCOUTEQLZGFXLS-UHFFFAOYSA-N 294.401 3.234 70 20 CGID CCc1ccc([C@@H](C)NC[C@H]2CCCC[C@@H]2O)o1 160656726 PFAUQXISEAEVDM-BZPMIXESSA-N 251.370 3.044 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H](COC)C2CC2)C1 159458411 ZGGNZTPAMCPIEG-IHRRRGAJSA-N 257.443 3.065 70 20 CGID Cc1cc(NC(=O)CCCc2sccc2C)no1 159918065 MTOSTKUQVZZMDW-UHFFFAOYSA-N 264.350 3.314 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N1CCN(c2ccccc2C)CC1 159711276 CQUJXUWRXUOVCR-QAPCUYQASA-N 286.419 3.080 70 20 CGID CCCOc1cccc(CN2CCCC[C@@H]2CCO)c1 159735357 LMXAQRBQJADNBI-MRXNPFEDSA-N 277.408 3.212 70 20 CGID CCCC(O)(CCC)CC(=O)N(C)CCc1ccccc1 159382549 DVESNULVOXWEME-UHFFFAOYSA-N 291.435 3.409 70 20 CGID CCN(CCCc1nc(-c2ccccc2)no1)C(C)C 159981528 OAOXQBLUEYAUEE-UHFFFAOYSA-N 273.380 3.400 70 20 CGID CCCCOCCCNCc1cccc(OC)c1F 160294035 VTOAOPAZYXQKQT-UHFFFAOYSA-N 269.360 3.131 70 20 CGID CCCN(Cc1ccccc1)Cc1c(C)n[nH]c1C 160482056 XDAXFUUTXCUNFL-UHFFFAOYSA-N 257.381 3.439 70 20 CGID Fc1cc(Cl)cc(CNC[C@H]2CCN(C3CC3)C2)c1 160892171 FFVZMEULRWDXRV-LLVKDONJSA-N 282.790 3.053 70 20 CGID CCO[C@@H]1C[C@H](N[C@@H](C)c2cnn(C)c2)C1(CC)CC 161302449 RKPDDOUQKJGONY-AEGPPILISA-N 279.428 3.055 70 20 CGID CCCCOc1ccc(CCN[C@H](C)[C@H]2CCOC2)cc1 161388349 QBFHLDJGZGCMIJ-WBVHZDCISA-N 291.435 3.423 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2nnc(C(C)C)o2)n1 160384975 NBPRXHJXWUWPHY-CQSZACIVSA-N 286.379 3.234 70 20 CGID CC[C@@H](NC(=O)c1ccccc1OC)c1c(C)noc1C 160433744 OQRFRDPMNUAJTA-CYBMUJFWSA-N 288.347 3.181 70 20 CGID C[C@H]1CN(C)CC[C@@H]1NCC1(Sc2ccccc2)CC1 160487388 JBCHIOHHXHREAX-HOCLYGCPSA-N 290.476 3.241 70 20 CGID Cc1nc(CCNC(=O)N[C@@H](C)CC(C)C)sc1C 160519799 DWTRTXFHENWOOY-JTQLQIEISA-N 283.441 3.036 70 20 CGID Cc1ccc(OC(F)F)c([C@@H](C)NCC(C)(C)O)c1 160604708 PUNHSQUMXIOFAK-SNVBAGLBSA-N 273.323 3.018 70 20 CGID O=C(CCc1ccsc1)N1CCc2c(F)cccc2C1 160963903 DYCGUTSKOAYPKB-UHFFFAOYSA-N 289.375 3.405 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1F 159672951 VZKIPOJSIZWGFB-LBPRGKRZSA-N 295.329 3.186 70 20 CGID Cc1cc(NC(=O)c2sccc2C(C)C)c[nH]c1=O 159765936 JIZFGWUZWGTAES-UHFFFAOYSA-N 276.361 3.121 70 20 CGID CC[C@H](C)OCC(=O)Nc1cccc(COC(C)C)c1 161299110 UVJVCPBKVFQKAK-ZDUSSCGKSA-N 279.380 3.365 70 20 CGID O=C(Nc1ccc(Br)c(F)c1)NC1CC=CC1 161433249 TUMJMXIZQHONNJ-UHFFFAOYSA-N 299.143 3.428 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cc2ccccc2n1C 161458124 PKNNLMAOPLKUNE-TXEJJXNPSA-N 256.349 3.191 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@@H]1CCCC[C@@H]1C 160006417 JYTZIBQJUIKVRS-BBRMVZONSA-N 289.423 3.058 70 20 CGID C[C@H](Oc1ccc(F)c(F)c1)C(=O)NCC1(C2CC2)CC1 160031227 AMNLUIMHUCUJNJ-JTQLQIEISA-N 295.329 3.039 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@@H]1COc2ccccc21 160035171 OLOTZRGMOQNBPT-KGLIPLIRSA-N 299.395 3.418 70 20 CGID COc1ccc(N(C)C(=O)C[C@@H]2CCCCO2)cc1Cl 160148278 CLVMXDWMSMXEEK-LBPRGKRZSA-N 297.782 3.271 70 20 CGID Cn1cccc1CNc1cccc(C(=O)NC(C)(C)C)c1 160206090 XQMOMMJMVWHTTE-UHFFFAOYSA-N 285.391 3.166 70 20 CGID CCN1CCC(NC(=O)C[C@@H]2CCCC(C)(C)C2)CC1 160336378 VMYZJIIGNJJPSB-AWEZNQCLSA-N 280.456 3.193 70 20 CGID CCSCc1cccc(NC(=O)[C@@H]2CCC[C@@H](N)C2)c1 160423052 DQFOQZKEYCYUIT-ZIAGYGMSSA-N 292.448 3.396 70 20 CGID CCC(CC)n1nccc1C(=O)N1C[C@@H](C)C[C@H](C)C1 160519864 GIUNXWDYKJCKNE-STQMWFEESA-N 277.412 3.362 70 20 CGID CCS[C@@H](C(=O)N(C)c1ccc2c(c1)OCO2)C(C)C 160640948 JSRMTGDJWILLJM-CQSZACIVSA-N 295.404 3.156 70 20 CGID C[C@H](C(=O)Nc1cccc(OCCF)c1)C1CC1 160649835 JUYCQHNYBYEKPX-JTQLQIEISA-N 251.301 3.020 70 20 CGID CCCC1(CNC(=O)c2ncccc2OCC(F)F)CC1 160680752 ZXKFYKGUIBKWJS-UHFFFAOYSA-N 298.333 3.036 70 20 CGID CCN(CC)C(=O)C[C@@H](C)N[C@H](C)Cc1ccccc1C 160772219 LAPZIIWLZBZDOU-HZPDHXFCSA-N 290.451 3.163 70 20 CGID CCCCOc1cccc(CN[C@H](COC)C2CC2)c1 160838415 WKCSIBLVRXHVTJ-QGZVFWFLSA-N 277.408 3.380 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1ccnc(SC)c1 159761188 DVYJVXHTENUJMQ-JQWIXIFHSA-N 264.394 3.112 70 20 CGID CCOC(CCN[C@H](C)Cc1ccc(F)cc1)OCC 159545552 JCFTWKZKTPAPRX-CYBMUJFWSA-N 283.387 3.136 70 20 CGID Cc1c(CNCc2ccc3ccccc3c2)cnn1C 161044239 IICMIQRIDABPHJ-UHFFFAOYSA-N 265.360 3.172 70 20 CGID COC(=O)CCCN1CCC[C@H]1Cc1ccccc1Cl 217223740 JUTFOXNJCPJYDA-AWEZNQCLSA-N 295.810 3.300 70 20 CGID CNC[C@H](C)C(=O)N1CCCC[C@H]1c1cccc(C)c1C 161338104 OMZIZDFRFQKVRE-YOEHRIQHSA-N 288.435 3.213 70 20 CGID Fc1ccc2oc(N[C@H]3[C@H]4CCO[C@@H]4C34CCC4)nc2c1 160101838 VDERYIGYLGLVMW-SWHYSGLUSA-N 288.322 3.336 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccccc1 160375931 WYJUUBQJUQXGSC-HNNXBMFYSA-N 273.376 3.298 70 20 CGID CC[C@@H](NC(=O)CCC1CC1)c1c(C)noc1C 160512502 GMLFUEUCRVYEAP-GFCCVEGCSA-N 250.342 3.049 70 20 CGID C[C@]1(CNC(=O)N[C@H]2CCCc3occc32)CCCS1 160672721 NQIHOBQOMLUPLD-SWLSCSKDSA-N 294.420 3.242 70 20 CGID COC(=O)c1cccc(NC(=O)Nc2cscc2C)c1 160700754 IGVZRRKAMZAPLD-UHFFFAOYSA-N 290.344 3.487 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccnc(N(C)C)c1 160925505 IDXFQHRQUDFAJD-HIFRSBDPSA-N 289.423 3.188 70 20 CGID CCOc1cccc(NC(=O)NC2C[C@H](C)O[C@@H](C)C2)c1 159636030 DOMSQTBSBWDDHH-RYUDHWBXSA-N 292.379 3.163 70 20 CGID O[C@@H](Cc1ccccc1)CN(Cc1ccc(F)cc1)C1CC1 218760772 LESVBULOCRFKJC-IBGZPJMESA-N 299.389 3.394 70 20 CGID COc1ccc(NC(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)cc1N 161048541 QEYVMOWZRQAVDD-SWLSCSKDSA-N 288.391 3.454 70 20 CGID CO[C@]1(CN[C@@H]2CCC(C)(C)c3ccccc32)CCOC1 160101941 NWOBYKQKTQAEMM-AEFFLSMTSA-N 289.419 3.194 70 20 CGID CC[C@@H](NC(=O)Cc1ccsc1)c1c(C)noc1C 160174226 VPCLHCQQOLENBP-GFCCVEGCSA-N 278.377 3.163 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)c1cc(C)c(C)cc1C 160406371 OXUFSHUUFPSHBI-LSDHHAIUSA-N 281.465 3.376 70 20 CGID O=C(CCc1ccsc1)N[C@@H]1CCOC2(CCCC2)C1 159422819 XSKLNJVOYFVZBN-CQSZACIVSA-N 293.432 3.289 70 20 CGID CCCCN(C(=O)[C@H](C)N)[C@@H](CC)c1ccccc1 159781143 NOOFOWZBYWXUKV-ZFWWWQNUSA-N 262.397 3.114 70 20 CGID C1CCC(OC2CCN(CCOCC3CC3)CC2)CC1 159888798 LDBSFWZETOUIRT-UHFFFAOYSA-N 281.440 3.227 70 20 CGID CCOC(=O)[C@H](N[C@@H]1CCCC[C@@H]1C)c1ccccc1 217683453 DLQSZMQDLAAFLV-NUEKZKHPSA-N 275.392 3.459 70 20 CGID CC[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccccc1 217687954 AJIFWQUCXMDEPG-ULQDDVLXSA-N 258.409 3.354 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)CCC2CC2)n1 161038754 ZIZJXGPFYNASKV-UHFFFAOYSA-N 284.363 3.163 70 20 CGID C[C@H](N[C@H](C)c1ccc(OCc2nccn2C)cc1)C1CC1 160118290 WUJDHRVYFBXOND-UONOGXRCSA-N 299.418 3.448 70 20 CGID CCN(C(=O)C[C@H](C)SC)c1ccccc1C 160146683 CAOGKGMOQXRYPP-LBPRGKRZSA-N 251.395 3.490 70 20 CGID OCC1(CN[C@H](c2ccccc2)C(F)(F)F)CCCC1 160149108 UGPJOQARXMCKJR-CYBMUJFWSA-N 287.325 3.432 70 20 CGID C[C@@H]1C[C@@H]1c1cc(NC(=O)CC2CCSCC2)[nH]n1 160317437 HLQKVCJCKMSZRA-KOLCDFICSA-N 279.409 3.005 70 20 CGID C[C@H]1CCCN(C(=O)N[C@@H]2CCCC(C)(C)C2)C1 160720866 BQPORXMABPQGTR-QWHCGFSZSA-N 252.402 3.397 70 20 CGID CCc1noc([C@H](C)Nc2ccn(CCC(C)C)n2)n1 159894955 KYRADODTGHRFEC-NSHDSACASA-N 277.372 3.048 70 20 CGID CCN(CC)CCSc1nc(C(C)(C)C)ns1 159735100 UNLAHRPVCKLYCZ-UHFFFAOYSA-N 273.471 3.270 70 20 CGID COCC[C@H](C)N[C@H]1CCCc2cc(F)ccc21 159553564 LEXDIIYUYZRMOT-NHYWBVRUSA-N 251.345 3.218 70 20 CGID CCCCc1ccc(C(=O)N2CCC(C)(O)CC2)cc1 161271443 FUSHCHOZUFGBAC-UHFFFAOYSA-N 275.392 3.016 70 20 CGID Fc1cccc(Br)c1CNCC1CC1 160260345 FEQJHVSDOKJNKA-UHFFFAOYSA-N 258.134 3.088 70 20 CGID O=S(=O)(Cl)[C@H]1CCCC[C@H]1c1ccccc1 88251583 RJCAPJKKRJGVKO-RYUDHWBXSA-N 258.770 3.281 70 20 CGID COCCC1(CNC(=O)NC(C)(C)CC(C)(C)C)CC1 161029410 WMIUWOLAXJWZQG-UHFFFAOYSA-N 284.444 3.317 70 20 CGID CS[C@H](C)CNC(=O)[C@H](OC(C)(C)C)c1ccccc1 161311147 TYLGBMJJSAYHDT-TZMCWYRMSA-N 295.448 3.411 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCC[S@@](=O)c1ccccc1 161424224 QRJUJLRELVUDKV-ALKREAHSSA-N 279.449 3.353 70 20 CGID COc1c(F)cc(NC(=O)N[C@H](C)C2CCC2)cc1F 161466876 YVADQLBTCYTBRZ-MRVPVSSYSA-N 284.306 3.284 70 20 CGID CCCCn1ncc(NC(=O)NC[C@@H]2CCCS2)c1C 159765964 ZCGDICBZNHUBBC-LBPRGKRZSA-N 296.440 3.009 70 20 CGID Cn1cc([C@@H]2CCCN2C(=O)C2CCC(C)(C)CC2)cn1 159995736 QBQLFJBQCBTFEY-HNNXBMFYSA-N 289.423 3.300 70 20 CGID O=S(=O)(Cl)Cc1ccc(-c2ccc(F)cc2)o1 390586553 NEXWTVFIEUKICX-UHFFFAOYSA-N 274.700 3.154 70 20 CGID CCSCC[C@@H](C)NC[C@@H](O)c1c(F)cccc1F 160086410 LPZMHZFVSOGJOB-ZWNOBZJWSA-N 289.391 3.120 70 20 CGID N[C@@H]1CCCC[C@H]1NC(=O)c1cc2ccc(F)cc2s1 161196985 QBETZMZLYRYNJE-VXGBXAGGSA-N 292.379 3.040 70 20 CGID CCc1ccc([C@@H](CC)N[C@@H](CCO)CSC)cc1 160258435 GNGRHKIVAAAPLY-JKSUJKDBSA-N 281.465 3.404 70 20 CGID FC(F)(F)c1ccc(N[C@H]2CCO[C@H](C3CC3)C2)nc1 160307902 VLXYFIDOSZJNRK-RYUDHWBXSA-N 286.297 3.470 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1cccc(F)n1 160542040 CLHNUIDSAIWRLD-NXEZZACHSA-N 276.336 3.333 70 20 CGID CCOc1cncc(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160548248 BWPXWXYUXBCMOV-LSDHHAIUSA-N 299.374 3.208 70 20 CGID CCC(CC)(CNCc1ncc(C(C)(C)C)o1)C(=O)OC 159671421 QFLWJLDXGAREGY-UHFFFAOYSA-N 296.411 3.041 70 20 CGID Cc1[nH]c2ccc(Cl)cc2c1C(=O)NC1CCOCC1 159562093 VBSGXCLKBAVFLH-UHFFFAOYSA-N 292.766 3.039 70 20 CGID COc1ccc(OC)c([C@H](O)CN2[C@@H](C)CCC[C@H]2C)c1 216888134 CINIZUCODDSNLD-DVOMOZLQSA-N 293.407 3.000 70 20 CGID Cc1cscc1C(=O)N[C@H]1CCCc2cc(N)ccc21 159371441 DKXKZPOVTAABNB-HNNXBMFYSA-N 286.400 3.446 70 20 CGID CC(C)NC(=O)CN[C@H](C)c1cc(Cl)cc(Cl)c1 160992503 RMNCTURWGWHURA-SECBINFHSA-N 289.206 3.169 70 20 CGID Cc1cccc(-c2nc(-c3cccc(N)c3)no2)c1F 161427426 ALRXPHZZLHGICX-UHFFFAOYSA-N 269.279 3.433 70 20 CGID C[C@H](NC(=O)C[C@@H]1CCCCC1(C)C)C(=O)NC(C)(C)C 161095582 UNQZIALQKOOLGT-STQMWFEESA-N 296.455 3.012 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc(C)nc1 161303941 NMJPHUXYPHITAX-HNNXBMFYSA-N 297.358 3.208 70 20 CGID CC1(C)C[C@@H](NC(=O)NCCCC2CCCC2)CCO1 161444803 CPTCFURAEKUQLF-AWEZNQCLSA-N 282.428 3.214 70 20 CGID CSc1ccsc1C(=O)N1[C@@H](C)CC[C@H]1C 161497658 IGDWSVSPHIXECO-DTORHVGOSA-N 255.408 3.483 70 20 CGID COc1ccc(N(C)C(=O)c2ccco2)cc1Cl 160023157 ZRUSCMXLAMYZCE-UHFFFAOYSA-N 265.696 3.218 70 20 CGID CC(C)C[C@H](C)OCCC(=O)NCC1(C2CC2)CC1 160088843 KXJLDKLJTAZWNF-ZDUSSCGKSA-N 267.413 3.134 70 20 CGID CSC[C@@H](CCO)N[C@H](C)C(C)(C)c1ccccc1 160173060 QBJHUOFIIGXGAC-UKRRQHHQSA-N 281.465 3.056 70 20 CGID CCCCCNC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 160292963 NERARBOPOKXEMD-OAHLLOKOSA-N 292.379 3.166 70 20 CGID C[C@@H](NC(=O)Nc1ccc(-n2cccn2)cc1)C1CCC1 160302828 HDVVDBZXOWYWHG-GFCCVEGCSA-N 284.363 3.182 70 20 CGID CCSCc1cccc(NC(=O)[C@H](N)CC(C)C)c1 160421586 DNUQDJVPLUCLFQ-CQSZACIVSA-N 280.437 3.252 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCc1ccccc1OC(F)F 160554909 NQCIGIHWBWDDMF-XHDPSFHLSA-N 283.318 3.340 70 20 CGID Cc1cc(NC(=O)[C@H](Cc2ccccc2)C(C)C)c[nH]c1=O 159811834 ZXACZOXLJQVKCN-MRXNPFEDSA-N 298.386 3.137 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@@H]2CCCCO2)C1 159639992 YIOZERAKDKZZQL-JSGCOSHPSA-N 291.416 3.331 70 20 CGID CCC1CCC(NC(=O)NCCc2ccncc2C)CC1 159672129 CBOXVRYPUOPTDL-UHFFFAOYSA-N 289.423 3.201 70 20 CGID CCC(CC)[C@@H]1C[C@H](N[C@@H](C)CCn2cccn2)CCO1 159496379 OGOPAYLUYGQQPN-UAGQMJEPSA-N 293.455 3.235 70 20 CGID O=C(NCc1ccc(CN2CCCCC2)cc1)C1=CCCC1 159736568 FXUJCOAHNFJHEE-UHFFFAOYSA-N 298.430 3.399 70 20 CGID CC(C)S(=O)(=O)CCCN1c2ccccc2CC[C@@H]1C 160544455 MJESCIWOSOTRCO-AWEZNQCLSA-N 295.448 3.041 70 20 CGID C/C=C\C(=O)N(C)Cc1csc(Br)c1 216828891 DIGUIEFULRAWQQ-ARJAWSKDSA-N 274.183 3.045 70 20 CGID CCOc1ccc(CNC(=O)N2CCC[C@H](C)C2)cc1 217300876 KKHYAVBDTOJWBA-ZDUSSCGKSA-N 276.380 3.027 70 20 CGID Cc1ccc(OCCCNC(=O)NCCC(C)C)cc1 217297975 NHWNGLOBMMMVKC-UHFFFAOYSA-N 278.396 3.109 70 20 CGID FC(F)(F)c1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1 217654573 VJSSOMRHRWVQMD-GJZGRUSLSA-N 298.352 3.422 70 20 CGID CCCCCCC(=O)Nc1ccc(S(=O)(=O)F)cc1 865204180 IHLYHSPSPMNHEJ-UHFFFAOYSA-N 287.356 3.254 70 20 CGID CC1=C(C(=O)Nc2cnc(Cl)cc2C)CCCO1 160001070 FNBJPILKXIJNMP-UHFFFAOYSA-N 266.728 3.066 70 20 CGID CC(C)CCn1ccc(NC(=O)N[C@H]2CCC[C@@H]2C)n1 160486503 XQHPXZYJBPUCOJ-STQMWFEESA-N 278.400 3.239 70 20 CGID Cc1cc(NC(=O)N(C)[C@@H]2CCSC2)ccc1N(C)C 160692805 BRYGGTCYJZBAMX-CYBMUJFWSA-N 293.436 3.030 70 20 CGID C[C@@H]1CCCN(CC2CCN(C(=O)C(C)(C)C)CC2)[C@@H]1C 159805146 MEALMHGEGHETOD-HUUCEWRRSA-N 294.483 3.392 70 20 CGID CN(C)C[C@@H]1CCCCN1C(=O)C1CCC(C)(C)CC1 159418548 NVCNCBRGFOSVKT-HNNXBMFYSA-N 280.456 3.146 70 20 CGID COc1ccc(N(C)C(=O)CC[C@H]2CC[C@H](C)O2)cc1F 159456771 FUVGLTHSXYYGLB-WCQYABFASA-N 295.354 3.145 70 20 CGID CC1(C)CCC(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)CC1 159362753 QHHPPYNMEMCVIB-KFWWJZLASA-N 279.424 3.277 70 20 CGID CN(Cc1nccs1)C(=O)CCc1ccc(F)cc1F 159787739 CFYMHGKNNHPIJT-UHFFFAOYSA-N 296.342 3.013 70 20 CGID CCCn1nccc1CNc1ccc(OC)c(F)c1 160000648 QGOTXHPMHALSJJ-UHFFFAOYSA-N 263.316 3.053 70 20 CGID CCCN(c1ccncc1Br)C1CC1 159952029 TVFBQWAZYCJXRI-UHFFFAOYSA-N 255.159 3.223 70 20 CGID CC(C)c1nc(C(=O)Nc2cccc(F)n2)cs1 160869460 CZJBTJZFTKMMHF-UHFFFAOYSA-N 265.313 3.053 70 20 CGID CC(C)(C)NC(=O)NCC12CC3CC(CC(C3)C1)C2 217276045 UTSHRPDMXUFMHN-UHFFFAOYSA-N 264.413 3.301 70 20 CGID CCCN(CC1CC1)C(=O)c1cc(OC)c(OC)cc1F 161299027 FQTMHLXCXVERPE-UHFFFAOYSA-N 295.354 3.105 70 20 CGID COc1ccc(NC(=O)[C@H]2[C@@H](C=C(C)C)C2(C)C)cc1N 161048447 QEYVMOWZRQAVDD-IUODEOHRSA-N 288.391 3.454 70 20 CGID COC[C@H](N[C@H]1CCOc2c(Cl)cccc21)C1CC1 161293301 YIKFNCQHBLIJKL-KBPBESRZSA-N 281.783 3.178 70 20 CGID CCCN1CCC(NCC2(c3ccc(F)cc3)CC2)CC1 161347241 YOKVLCFWCISLRT-UHFFFAOYSA-N 290.426 3.321 70 20 CGID CCc1noc(C)c1CS[C@H](C)C(=O)N(C)C(C)C 160017728 MDZIBKMWODJLKA-LLVKDONJSA-N 284.425 3.034 70 20 CGID CC[C@H](C)[C@H](C)NCc1ccc(OC(C)C)nc1 160039997 GPRJTOSUJBEQEA-STQMWFEESA-N 250.386 3.393 70 20 CGID Cc1ccc(-c2nnc(NC(=O)C[C@H]3CC[C@H](C)C3)[nH]2)o1 160188095 IAKMATABNZKXMP-ONGXEEELSA-N 288.351 3.138 70 20 CGID COCCCCCNC(=O)c1ccc(F)c(SC)c1 160458685 GCPPAYQYORTSAF-UHFFFAOYSA-N 285.384 3.094 70 20 CGID Cc1ccc(C)c(NC(=O)N[C@H]2CCOC(C)(C)C2)c1 160632343 BQUCFXWRALBUHM-ZDUSSCGKSA-N 276.380 3.383 70 20 CGID Cc1cc(F)cc(NC(=O)[C@H]2CCC(=O)C[C@H]2C)c1 160662508 OIFOZPZOSVWOFM-YGRLFVJLSA-N 263.312 3.078 70 20 CGID C[C@H](N[C@@H](C)c1ccoc1)C(=O)N1c2ccccc2C[C@@H]1C 160826937 YFGDYERMCBJCFY-IHRRRGAJSA-N 298.386 3.297 70 20 CGID Cc1nc(CC(=O)N2C[C@@H](C)CCC[C@H]2C)c(C)s1 159490308 QKMUFGRUWJECAQ-WDEREUQCSA-N 280.437 3.340 70 20 CGID O=C(CC(F)(F)F)N[C@H]1CCCc2sccc21 159930989 QUMXPCAAEVSDMR-QMMMGPOBSA-N 263.284 3.194 70 20 CGID CCSCC[C@@H](C)NC(=O)C[C@H]1CNc2ccccc21 160228028 DQCPERHEMMFCKT-OLZOCXBDSA-N 292.448 3.234 70 20 CGID CN1CCC[C@@H]1CNCc1ccc(F)c(C(F)(F)F)c1 160982964 GPBQNRVHKFDGEB-LLVKDONJSA-N 290.304 3.028 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2ccccn2)n1 159792850 WDVYTKXBRRSOCC-MRXNPFEDSA-N 253.349 3.122 70 20 CGID COCC[C@@H](C)N[C@H](c1ccc2c(c1)OCCO2)C(C)C 161038110 BMYMPXSYWXMLRJ-DYVFJYSZSA-N 293.407 3.170 70 20 CGID CCn1cc([C@@H](C)NCC2(c3ccc(F)cc3)CC2)cn1 161349011 RODXTBXZKCQAEN-CYBMUJFWSA-N 287.382 3.425 70 20 CGID CC[C@H]1CCCC[C@H]1NCc1cnn(C)c1C(F)(F)F 161433367 KONUQQJQHLLILA-CMPLNLGQSA-N 289.345 3.497 70 20 CGID CC[C@@H](C)[C@@H](C)NCc1ccccc1CN1CCOCC1 160427852 ATXFYZGWUQLBEJ-HZPDHXFCSA-N 290.451 3.043 70 20 CGID CCC(N)(CC)CNC(=O)C1(c2ccccc2)CCCC1 160526983 QVGRWGSGNJVJOX-UHFFFAOYSA-N 288.435 3.132 70 20 CGID C[C@H](C(=O)NCc1ccccc1)c1c(F)cccc1F 160598704 LZGKKPLNJAEVMP-NSHDSACASA-N 275.298 3.385 70 20 CGID CC1(CC(=O)Nc2ccc(OCCO)cc2)CCCCC1 160626913 MYCKYKCITIPYCA-UHFFFAOYSA-N 291.391 3.357 70 20 CGID CCN(C)C(=O)N[C@@H](c1ccco1)c1ccccc1OC 160662827 GYWAAYJJPNALGF-OAHLLOKOSA-N 288.347 3.039 70 20 CGID CSc1ccccc1NC(=O)N[C@H]1CCOC(C)(C)C1 160876895 JUWHOEPTPLGXBH-NSHDSACASA-N 294.420 3.488 70 20 CGID CC(C)n1cc([C@H](C)N[C@H]2CCCSC2)cn1 159640587 DUUCOPYVURJWQW-AAEUAGOBSA-N 253.415 3.010 70 20 CGID O=C(CCc1c[nH]c2ccccc12)NCC1(C2CC2)CC1 159851013 NJHNJNVBOMFSJD-UHFFFAOYSA-N 282.387 3.407 70 20 CGID CCCCN(C(=O)[C@H]1CCCCO1)c1ccccc1 159744277 ZVVGFXHTKQNCJD-OAHLLOKOSA-N 261.365 3.389 70 20 CGID FC(F)(F)COCCCN1CC[C@@H]2CCCC[C@@H]21 160557282 VTSBNIBCBQANEQ-RYUDHWBXSA-N 265.319 3.220 70 20 CGID CC(C)[C@@H](O)C(C)(C)CNc1nc(C(C)(C)C)ns1 160099011 XMOQJELTADUKGB-SNVBAGLBSA-N 285.457 3.291 70 20 CGID CCC(C)(C)C(=O)N[C@@H]1CCc2c(OC)cccc21 160133404 NTWYYTRWUGRACL-CYBMUJFWSA-N 261.365 3.235 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NCCc1ccccn1)C2 217899072 IEIVBPFGIJRAEW-QRTARXTBSA-N 258.409 3.429 70 20 CGID O[C@@H](CN1CCC[C@@H]2CCCC[C@@H]21)c1ccccc1 217547738 JWNHNNODWXGCRK-XIRDDKMYSA-N 259.393 3.375 70 20 CGID Cc1cccc([C@@H](C)C(=O)N(C)Cc2cccn2C)c1 161004320 KZGWGWIFVQMTBU-CQSZACIVSA-N 270.376 3.096 70 20 CGID COCCC1(CNC(=O)N2C[C@@H](C)c3ccccc32)CC1 161062265 ZKSRTSHLTWZSTL-CYBMUJFWSA-N 288.391 3.136 70 20 CGID CCOc1cccc(NC(=O)NCC(CC)(CC)CO)c1 161091835 YVCSFRGPQLPZRK-UHFFFAOYSA-N 294.395 3.006 70 20 CGID CC[C@H](C(=O)NC[C@@H](C)SC)c1ccc(F)cc1 161336157 MXFWRTXUIAKCGO-MFKMUULPSA-N 269.385 3.187 70 20 CGID COC(=O)c1ccc(NC(=O)c2cccc(C)c2F)cc1 161387978 QMJKGMVGCHPWKC-UHFFFAOYSA-N 287.290 3.173 70 20 CGID Cc1cccc(CNC(=O)COc2ccc3[nH]ccc3c2)c1 160042267 IBNOJNFOXDXOSK-UHFFFAOYSA-N 294.354 3.172 70 20 CGID CCOCCC1(CNC(=O)N[C@H]2CCC[C@@H]2CC)CC1 160230420 RPQAFKJBGQGAKF-KBPBESRZSA-N 282.428 3.071 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)NCC1(C2CC2)CC1 160237191 VPYMDTXAOSIUBL-DGCLKSJQSA-N 250.386 3.055 70 20 CGID Cn1ccc(CNC(=O)C[C@@H]2CCCCC2(C)C)c1 160425000 DTPAUQMRWRYYLH-AWEZNQCLSA-N 262.397 3.248 70 20 CGID Cc1nnc(NC(=O)C(C)(C)C2CCCC2)s1 160678342 WNUQQPOCZQDYOW-UHFFFAOYSA-N 253.371 3.001 70 20 CGID CCCCn1ncc(C(=O)N2[C@@H](C)CCC[C@@H]2C)c1C 160765630 HOHNNVWAXUBCTF-STQMWFEESA-N 277.412 3.395 70 20 CGID Cc1ccc([C@@H](C)NCC[S@](=O)c2ccccc2)cc1 160789608 GMLBGOZYYAODNF-FOIQADDNSA-N 287.428 3.453 70 20 CGID CCc1nnc([C@H](C)N[C@@H](C)c2cccc(F)c2F)o1 159406461 AXRQIKOLQJMERN-IUCAKERBSA-N 281.306 3.322 70 20 CGID CCC[C@H](C)N(C)c1ccncc1Br 159955225 VNYQOAJCVKPYDK-VIFPVBQESA-N 257.175 3.469 70 20 CGID CN(CCc1nccs1)C(=O)Nc1c(F)cccc1F 159908869 DGTZKPFIVDMSAP-UHFFFAOYSA-N 297.330 3.128 70 20 CGID CC[C@H](C(=O)Nc1ccc(F)cn1)c1ccc(F)cc1 159759041 DNFUUWOIOBSRLM-ZDUSSCGKSA-N 276.286 3.492 70 20 CGID C[C@H](C[C@H](O)c1ccco1)Nc1nc(C(C)(C)C)ns1 159960738 JGORHCXONLMJRC-ZJUUUORDSA-N 295.408 3.353 70 20 CGID Cc1nn(C)cc1CN[C@@H](c1ccccc1)c1ccccn1 159586663 XYCHKMURCPIEDO-SFHVURJKSA-N 292.386 3.003 70 20 CGID CC(C)[C@H](CCO)NC(=O)c1cc2c(s1)CC[C@H](C)C2 160746804 OMRCYZMQRVEKRW-AAEUAGOBSA-N 295.448 3.010 70 20 CGID Cc1cccc(C(=O)N[C@H](C)CCc2ccco2)c1F 161410982 RJBLQZYELYHPMU-GFCCVEGCSA-N 275.323 3.478 70 20 CGID C[C@@H](CSC(C)(C)C)NCc1cn2ccccc2n1 159420573 IYELVIIOJIIYQL-LBPRGKRZSA-N 277.437 3.344 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1c1nc([C@@H]2CCOC2)no1 161028567 RWWLBITYVCSFEG-GMTAPVOTSA-N 276.361 3.215 70 20 CGID O=C(Nc1cc(F)ccc1Cl)N1CCOC2(CCC2)C1 161136315 HCBNELVQONTYHB-UHFFFAOYSA-N 298.745 3.266 70 20 CGID C[C@H]1[C@@H](C)OCCN1C(=O)CCC(C)(C)c1ccccc1 160046992 QFMMCESFLKQYSS-LSDHHAIUSA-N 289.419 3.380 70 20 CGID CC[C@H](NC(=O)C1(CC)CCC1)c1c(C)noc1C 160210268 RBHBPLQXLSTTCU-LBPRGKRZSA-N 264.369 3.439 70 20 CGID CCCCN(C)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 160373261 WGAOHQQSAZCVAG-HNNXBMFYSA-N 292.379 3.118 70 20 CGID CC(C)Oc1ccccc1C(=O)NCCCC(C)(C)CO 160375906 BEGNDPNVACNFTA-UHFFFAOYSA-N 293.407 3.002 70 20 CGID CC(C)[C@H](C(=O)N(C)Cc1cccn1C)c1ccccc1 160734369 BJHSGRGPIWFOQM-KRWDZBQOSA-N 284.403 3.423 70 20 CGID FC(F)CN1CCC(NC[C@@H]2CCc3ccccc32)CC1 160976644 LNSKRKVZPXKNIM-AWEZNQCLSA-N 294.389 3.036 70 20 CGID Cc1cc(F)c(C(=O)N(C(C)C)C2CC2)cc1F 160983566 OPUBNGBFEWGRDE-UHFFFAOYSA-N 253.292 3.286 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)N[C@@H](C)c1ccccn1 159508288 HDELJIBAKPQCQU-AVGNSLFASA-N 286.400 3.432 70 20 CGID Cc1cc(NC(=O)[C@@H]2C[C@H]2c2sccc2C)no1 159918478 BLYIEQLPNFMPIC-NXEZZACHSA-N 262.334 3.095 70 20 CGID CC1(NC(=O)N[C@@H]2CCc3cc(F)ccc32)CCC1 159932681 IYWBTELBTGWFPM-CYBMUJFWSA-N 262.328 3.055 70 20 CGID Cc1ccccc1[C@H](C)NCCC(=O)N1CCCCCC1 159366749 PHXWYHZZFYSDTE-INIZCTEOSA-N 288.435 3.438 70 20 CGID CCc1noc(C)c1CNc1ccc(F)cc1OC 159379998 HNKRWMUVRGVXRZ-UHFFFAOYSA-N 264.300 3.305 70 20 CGID Cc1occc1CN(C)C(=O)C[C@H](C)c1ccncc1 159386839 SKYIGEYVQUQBCT-LBPRGKRZSA-N 272.348 3.135 70 20 CGID CC(C)(C)c1nsc(N[C@H]2CCN(C3CCCC3)C2)n1 159369071 GYGLDMCYLZBXAM-NSHDSACASA-N 294.468 3.264 70 20 CGID CCCn1nccc1CN[C@@H](C)c1ccc(C)cc1 160094624 AULGRGLOFXVWKW-AWEZNQCLSA-N 257.381 3.452 70 20 CGID OC[C@H](NCc1coc2ccccc12)c1ccccc1 161103281 KNMGKSLEFLCJFL-INIZCTEOSA-N 267.328 3.256 70 20 CGID Cc1nc(-c2ccccc2NC(=O)[C@@H]2CCCO2)cs1 218570055 NSWIQJOUAXYIMB-AWEZNQCLSA-N 288.372 3.236 70 20 CGID Cc1ccccc1N(CC(=O)NC1CCCC1)C(C)C 216925071 LRZDKFRVGSSKQA-UHFFFAOYSA-N 274.408 3.269 70 20 CGID CN(Cc1ccc(Cl)s1)C(=O)c1ccc(O)cc1O 217867374 PGQKYPKOXGTPDR-UHFFFAOYSA-N 297.763 3.085 70 20 CGID CN1CCC(N[C@@H]2CCCOc3c(Cl)cccc32)CC1 161445155 CDVUKHMXTYWKAK-OAHLLOKOSA-N 294.826 3.238 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCCO1)c1cc2ccccc2o1 160194506 KTFOCGFDXHGFCQ-BXUZGUMPSA-N 273.332 3.179 70 20 CGID C[C@H](NC1CCN(C2CCCC2)CC1)c1cncc(F)c1 160496098 NFZFCNPGUULXDG-ZDUSSCGKSA-N 291.414 3.278 70 20 CGID COc1cc(C)c(CN[C@H]2CCOC(C)(C)C2)cc1OC 160593526 JFHKXBGUDLLMQE-AWEZNQCLSA-N 293.407 3.059 70 20 CGID CN(Cc1ccccc1F)Cc1c[nH]nc1-c1cccnc1 160730687 ODLBIVZABMMRPC-UHFFFAOYSA-N 296.349 3.243 70 20 CGID C[C@@H](NCc1ccc(CN(C)C)cc1)c1cncs1 160865272 AQZZXWQRIJACKB-GFCCVEGCSA-N 275.421 3.056 70 20 CGID CCN(C)C(=O)Nc1cnn(-c2cc(C)ccc2C)c1C 160875269 GQGGPPNWKJUVSK-UHFFFAOYSA-N 286.379 3.281 70 20 CGID COc1ccc(N(C)C(=O)Cc2ccc(F)cc2)cc1F 159602520 PJLLMXYIUFRYSV-UHFFFAOYSA-N 291.297 3.179 70 20 CGID Cc1cccc([C@H](NC(=O)c2ccc[nH]2)c2ccccn2)c1 159810719 BEDAPMYKMIENBA-KRWDZBQOSA-N 291.354 3.238 70 20 CGID C[C@H]1SCCN(CCn2ccnc2)[C@@H]1c1ccccc1 159834724 YXFMJZNZDCUPCO-ZBFHGGJFSA-N 287.432 3.062 70 20 CGID CCN(CCCNC(=O)c1[nH]c(C)cc1C)c1ccccc1 159697404 UOKLLQWYMQCBSG-UHFFFAOYSA-N 299.418 3.278 70 20 CGID COCC[C@@H](C)N[C@H]1CCCc2cc(F)ccc21 159553729 LEXDIIYUYZRMOT-ABAIWWIYSA-N 251.345 3.218 70 20 CGID C[C@H](NCc1cccc2cc[nH]c12)c1cccnc1 218075127 VOFPRPURJAZXOW-LBPRGKRZSA-N 251.333 3.414 70 20 CGID C[C@H](NC1CCN(C2CCCC2)CC1)c1cncs1 160473527 DXBTYDVUBOZHMX-LBPRGKRZSA-N 279.453 3.201 70 20 CGID CSc1cc(C(=O)Nc2c(C)n[nH]c2C)ccc1F 161177151 BDHVVANDTNRUFM-UHFFFAOYSA-N 279.340 3.140 70 20 CGID CCc1ccc(CNc2ncnc(CC)c2F)s1 217973790 MVCUAHJEVMVCGP-UHFFFAOYSA-N 265.357 3.414 70 20 CGID CC(C)(C)c1ccccc1OCc1nnc2n1CCCC2 217323335 FEPWTTTYSNQAEB-UHFFFAOYSA-N 285.391 3.491 70 20 CGID C[C@H](c1ccc(F)c(Cl)c1)S(=O)(=O)Cl 88251455 UEXPKYZDGFONPN-RXMQYKEDSA-N 257.113 3.109 70 20 CGID COc1cc(F)c(C(=O)Nc2cccc(F)c2)cc1OC 161151813 WAKSJFLMXAMDGR-UHFFFAOYSA-N 293.269 3.234 70 20 CGID C[C@H](NC(=O)NO[C@@H]1CCCCO1)c1ccccc1Cl 161233980 AJNQMOQMBNRSIZ-GXFFZTMASA-N 298.770 3.158 70 20 CGID CCC[C@@H](C(=O)NCc1ccc(OC)c(OC)c1)C(C)C 160384259 IOOVXBZPGRZTOP-CQSZACIVSA-N 293.407 3.392 70 20 CGID Clc1cc(N[C@@H]2CCO[C@@H](C3CC3)C2)nc(C2CC2)n1 160474243 LAXUWAXXWYUWAX-VXGBXAGGSA-N 293.798 3.377 70 20 CGID CN(Cc1cccn1C)C(=O)CCSc1ccccc1 160744950 XOMAJGURAMYHOF-UHFFFAOYSA-N 288.416 3.166 70 20 CGID CCCCOc1cccc(CN[C@H]2CCN(C)[C@H](C)C2)c1 160815484 WAXIVDROTWTWQK-WBVHZDCISA-N 290.451 3.438 70 20 CGID CCC(C)(CC)C(=O)NCC(C)(C)c1ccncc1 159413648 MNFZDMLNVHNKHV-UHFFFAOYSA-N 262.397 3.302 70 20 CGID CS[C@@H](C)CC(=O)NCc1cc2ccccc2o1 159461036 LSGSEPAKSDAAME-JTQLQIEISA-N 263.362 3.191 70 20 CGID O=C(NCC(=O)c1cccs1)c1ccc(Cl)c(F)c1 159513074 CTKKTRXZMAQMSM-UHFFFAOYSA-N 297.738 3.153 70 20 CGID C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@@H]1CCCSC1 159517869 JKPFASMPMGFWKO-SMDDNHRTSA-N 296.411 3.028 70 20 CGID CCCCc1noc(CN(C)c2ccccc2OCC)n1 159376536 RMBVMWAAVQCGNT-UHFFFAOYSA-N 289.379 3.447 70 20 CGID Cc1cccc(CNC(=O)NC[C@]2(C)CCCS2)c1 159976024 OMVGGBDBNONAMZ-HNNXBMFYSA-N 278.421 3.080 70 20 CGID CCCC[C@H](CC)CNc1nccn2c(C)nnc12 218048422 OGVXCSUDKBHZAC-LBPRGKRZSA-N 261.373 3.061 70 20 CGID CCN(CCCO)C(=O)c1sc2cccc(F)c2c1C 160510251 KDDDQMOUMOAFPP-UHFFFAOYSA-N 295.379 3.193 70 20 CGID CN(C)C1(CNC2CC(c3ccccc3)C2)CCCC1 160705489 YJVKGNHKYUGHMT-UHFFFAOYSA-N 272.436 3.397 70 20 CGID CCCCCN1CCN(Cc2cc(F)ccc2OC)CC1 216776264 PNHLJCZDXSGMMP-UHFFFAOYSA-N 294.414 3.142 70 20 CGID O=C(Nc1ccc(OCc2nccs2)cc1)C1CC1 161266747 LWEIKSLKIBAEAV-UHFFFAOYSA-N 274.345 3.071 70 20 CGID CCOc1cc(Cl)ccc1CNC(=O)C(C)(C)COC 161471202 DKLPPGVOYRXEJS-UHFFFAOYSA-N 299.798 3.028 70 20 CGID Cc1cc(C)cc([C@H](C)NC(=O)c2ccc(O)nc2C)c1 161481000 LEFFCIYQNCWSGS-LBPRGKRZSA-N 284.359 3.203 70 20 CGID CC(C)[C@H](NC(=O)N[C@H](C)CCO)c1ccccc1Cl 160091029 GVYGXJPZFDAFIF-RISCZKNCSA-N 298.814 3.107 70 20 CGID CCOC(=O)[C@@H](Sc1nncc2ccccc12)C(C)C 160253340 OLQRUFYHCQGIKI-ZDUSSCGKSA-N 290.388 3.310 70 20 CGID O=C1CCc2cc(NCc3cc(F)cc(F)c3)ccc2N1 160535628 BASUYMHMWHUDLH-UHFFFAOYSA-N 288.297 3.462 70 20 CGID Cc1cccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1C 160660793 PCYRMEGXNOAHJB-CYBMUJFWSA-N 276.380 3.383 70 20 CGID CC(C)C[C@@H]1CCCCN1C(=O)CC1C[C@@H]2CC[C@H](C1)N2 160875756 CYPONYDZDCBESC-HMQMGEFJSA-N 292.467 3.334 70 20 CGID Cc1cccc(C)c1CN[C@H]1CCCc2c1cnn2C 160419495 YQDMKVREZFGSDJ-INIZCTEOSA-N 269.392 3.204 70 20 CGID CN(C[C@@H]1CCCCO1)C(=O)C(C)(C)C1CCCC1 160784386 IGFHWMQCVVYQTO-AWEZNQCLSA-N 267.413 3.230 70 20 CGID CC[C@H](C)N(C)CCNCc1ccc2ncccc2c1 217376794 WMCWAHAGPSKFRC-AWEZNQCLSA-N 271.408 3.055 70 20 CGID C[C@H](NC[C@H]1CCc2ccccc21)C1CCOCC1 161008624 NVQKNRUSFWQHBB-XJKSGUPXSA-N 259.393 3.121 70 20 CGID CC/C=C(/C)C(=O)N[C@@H](C)CC(=O)c1ccc(F)cc1 161185740 UXBDBMPUWJLCTF-QJGQKNTRSA-N 277.339 3.260 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1scnc1C 161227840 SCGPXPFOEUJUJQ-RYUDHWBXSA-N 266.410 3.492 70 20 CGID CCCCC(=O)N1CCC[C@H]1c1ccc(COC)o1 161350086 CXVAACFGTXOARM-ZDUSSCGKSA-N 265.353 3.280 70 20 CGID C[C@@H](NCCC1CCN(CC(F)(F)F)CC1)C1(C)CC1 160026518 YDDHBXVSNNGOOJ-GFCCVEGCSA-N 292.389 3.429 70 20 CGID CC[C@H](C(=O)N[C@H](C)CSC)c1ccc(F)cc1 160205306 YOCHNAWNVOZYBO-MFKMUULPSA-N 269.385 3.187 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)c1cccnc1 160220150 OSRGJGICKMHYNE-LBPRGKRZSA-N 271.316 3.317 70 20 CGID CC[C@H](C(=O)NC[C@H]1CCCCO1)c1ccc(F)cc1 159370903 CYYCMNNNIGSFMH-CABCVRRESA-N 279.355 3.005 70 20 CGID Cc1ccc(Cl)cc1C(=O)NCc1ccc(O)cc1 159529712 PNXGNUFRWNXAIF-UHFFFAOYSA-N 275.735 3.284 70 20 CGID C[C@@H]1CCC[C@@H](NCc2ccc(N(C)C)nc2)[C@@H]1C 159556321 HJYOGWZBOSTKKP-UMVBOHGHSA-N 261.413 3.062 70 20 CGID CCCn1nccc1CN[C@H](C)CCc1ccccc1 159984190 GYJWCUGUKHGLGE-OAHLLOKOSA-N 271.408 3.404 70 20 CGID O=C(CC1CCCCCC1)N1CCCC[C@@H]1CCO 161013473 IMSZZVFXHAWPPR-OAHLLOKOSA-N 267.413 3.110 70 20 CGID CCOc1cccc(NC(=O)N(C)[C@H]2CCSC2)c1 161415931 ITZIQVRSITZYAX-LBPRGKRZSA-N 280.393 3.055 70 20 CGID CC[C@H]1CCCC[C@@H]1NC[C@H](O)Cc1ccccc1 161422716 FKYCYLXXFQTKTI-BBWFWOEESA-N 261.409 3.148 70 20 CGID Cc1ccsc1CCCC(=O)N1CCOC(C)(C)C1 161425148 IJWWVPKIONKDAE-UHFFFAOYSA-N 281.421 3.017 70 20 CGID CC(C)(C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160277716 HQKSPTVOOASSHK-GFCCVEGCSA-N 253.386 3.031 70 20 CGID COc1cc(N[C@@H](C)C(=O)Nc2ccccc2)ccc1F 160310351 KPGWDDLAKSJCLC-NSHDSACASA-N 288.322 3.273 70 20 CGID CC[C@H](SC)C(=O)N[C@H](CC)c1c(C)noc1C 160576095 PJPBQVMQBKRPRJ-MNOVXSKESA-N 270.398 3.000 70 20 CGID CC[C@@H](C(=O)N(C)Cc1nccs1)c1ccc(F)cc1 160669809 NEDHQEXQLREORD-CYBMUJFWSA-N 292.379 3.434 70 20 CGID CCCC[C@@H](CCC)NC(=O)c1cnc2c(c1)ncn2C 160716924 AZPPZKJVGDMKEY-CYBMUJFWSA-N 288.395 3.057 70 20 CGID OCc1cccc(OCc2noc(C3CCCCC3)n2)c1 160928482 UMVBGZHCNSXJPD-UHFFFAOYSA-N 288.347 3.189 70 20 CGID CC[C@H](C)[C@@](C)(O)CNc1nc(C(C)(C)C)ns1 159448938 FWRHLKUFFAPXJN-ZANVPECISA-N 271.430 3.045 70 20 CGID COc1ccc(CN(C)Cc2ccc(OC)c(O)c2)cc1 159858512 GPUOJGQSJDAMMO-UHFFFAOYSA-N 287.359 3.041 70 20 CGID Cc1ccnc(N[C@H]2CCCc3cc(N)ccc32)c1 159493619 DFARPXJDOWTACF-HNNXBMFYSA-N 253.349 3.462 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1ccc(C(F)(F)F)cn1 161426738 CNNPTRCMEPKHMA-JTQLQIEISA-N 276.302 3.309 70 20 CGID Cc1nc(-c2ccccc2NC(=O)C2CC2)cs1 218569623 ROHVRTKJHFISGH-UHFFFAOYSA-N 258.346 3.467 70 20 CGID CCCn1nc(C)c(C(=O)N(C)c2ccccc2)c1C 161133006 KNLGIZNTRDOVJS-UHFFFAOYSA-N 271.364 3.187 70 20 CGID CC[C@@H](C)CS[C@H]1CCCN(CC(F)(F)F)C1=O 160045736 CPQCAUVGWLZRQZ-ZJUUUORDSA-N 283.359 3.319 70 20 CGID CCCO[C@H]1CCCN(Cc2ccc(C)cn2)CC1 160109105 IZIYMOOVEYFCII-INIZCTEOSA-N 262.397 3.171 70 20 CGID C[C@](O)(CNc1ccccn1)c1ccccc1Cl 160185537 CEFRPHZDUPWUFX-AWEZNQCLSA-N 262.740 3.055 70 20 CGID CCn1cc([C@@H](C)NC[C@@H](C2CCCCC2)N(C)C)cn1 160389556 CZBUOVKLKNHOGS-PBHICJAKSA-N 292.471 3.064 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)C2[C@@H]3CCC[C@@H]23)n1 160964044 TZXFMYVLJYZHID-GHMZBOCLSA-N 296.374 3.019 70 20 CGID C[C@H]1CCC[C@@H](C(=O)NCc2cccc(CN(C)C)c2)C1 159717240 FICARLJCDKSFRB-WMLDXEAASA-N 288.435 3.191 70 20 CGID Cc1cc(C)c(C(=O)Nc2ccnn2Cc2ccccc2)[nH]1 159975495 KOQPXDQSJMTVQB-UHFFFAOYSA-N 294.358 3.129 70 20 CGID Cc1ccccc1[C@H](C)NCc1csc(N(C)C)n1 159750708 HFEZDKYBWPPKMN-LBPRGKRZSA-N 275.421 3.368 70 20 CGID CC(C)(C(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CCC1 864239078 VOBMBJZHCNGHTD-UHFFFAOYSA-N 299.367 3.110 70 20 CGID C[C@H]1CCC[C@@H](CNC(=O)NCc2ccccc2)C1 218047620 DJJQJBKFYGCRFX-DZGCQCFKSA-N 260.381 3.312 70 20 CGID COC[C@H](NC(=O)[C@@H](C)Cc1ccc(Cl)cc1)C1CC1 161283849 XWEJRCWVSGOWKM-NHYWBVRUSA-N 295.810 3.060 70 20 CGID FC(F)(F)CCN(Cc1cnc2ccccn12)CC1CC1 161440534 GFUHSQNYGUVITQ-UHFFFAOYSA-N 297.324 3.499 70 20 CGID CCC(CC)(CC)CNC(=O)NCC(C)(C)C[C@H](C)O 160036812 YOPWMXVTDYXOHS-ZDUSSCGKSA-N 286.460 3.299 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1CSc2ccccc21 160180269 AMBDKGYGLJXFKL-ZDUSSCGKSA-N 273.401 3.182 70 20 CGID CC[C@@H](CC(=O)NCC1(O)CCCC1)c1ccc(C)cc1 160227788 FZMOAQIRBMEOQN-HNNXBMFYSA-N 289.419 3.300 70 20 CGID CC(C)[C@@H]1CCCCN1C(=O)N[C@H]1CCO[C@H](C2CC2)C1 160386042 NWFXOEBLIQBJEF-JYJNAYRXSA-N 294.439 3.164 70 20 CGID Cc1ccc(OCc2noc(C3CCCCC3)n2)cn1 160737849 HBIMFZOFCARNFR-UHFFFAOYSA-N 273.336 3.400 70 20 CGID CCN(C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)C1CC1 160927021 FCFYNIZZFJEIHS-HOCLYGCPSA-N 288.391 3.101 70 20 CGID Cc1ccc(NC(=O)c2cc(F)c(C)cc2F)nc1 159882397 KOLLPMLOFNWFMF-UHFFFAOYSA-N 262.259 3.229 70 20 CGID Cc1ocnc1C(=O)N1C[C@@H](C)CSc2ccccc21 159564982 RLZRCQYNZMPHPB-SNVBAGLBSA-N 288.372 3.372 70 20 CGID CCC(C)(CC)C(=O)N(C)c1nc2ccccc2n1C 159793260 DGSHAWMDDJWVJE-UHFFFAOYSA-N 273.380 3.362 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1ccnc(Cl)c1 159823864 KXSBRGNUZUZZHW-GXSJLCMTSA-N 252.745 3.044 70 20 CGID CCCC1(CNc2ccc(C(F)(F)F)nn2)CC1 218068627 GNYVFTNJUZONJL-UHFFFAOYSA-N 259.275 3.488 70 20 CGID CC(C)OCCCNC(=O)Nc1c(F)cccc1Cl 217313201 SMIQFWYOANOZBH-UHFFFAOYSA-N 288.750 3.416 70 20 CGID Cc1cccc2c1CC[C@@H]2N[C@H]1CCC[C@H](N(C)C)C1 161020509 KQQJAFLEJJJWLR-MPGHIAIKSA-N 272.436 3.445 70 20 CGID CC(C)C[C@H](C)NC(=O)NC[C@]1(C)CCCS1 160277370 IEEMDGCYPIVBMG-AAEUAGOBSA-N 258.431 3.006 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CCCC[C@H]2C)n1 161006272 QVUMKQYFHIFQOP-CYBMUJFWSA-N 278.400 3.336 70 20 CGID CCC(CC)(CN)C(=O)NCc1ccc2ccccc2c1 161175201 IRFXRQVWSPISDA-UHFFFAOYSA-N 284.403 3.221 70 20 CGID CCN1CCCC[C@H]1CN[C@@H](C)c1ccc(C)o1 161208793 QTNBVCQJUDQTBQ-KBPBESRZSA-N 250.386 3.113 70 20 CGID CC[C@@H](SC)c1nc(COc2ccccc2)no1 161243370 JMCZFDREFBJACD-LLVKDONJSA-N 264.350 3.463 70 20 CGID Cc1ccc(NC(=O)NCc2ccccc2C)cn1 161302816 HZIARAYYRCKSKW-UHFFFAOYSA-N 255.321 3.020 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)C2CC=CC2)o1 161335971 MNWIQUYRBQDOIQ-CQSZACIVSA-N 275.348 3.056 70 20 CGID COCC(C)(C)c1nc(-c2cccc(Cl)c2)no1 161357525 SDTLEFSOCKSMPE-UHFFFAOYSA-N 266.728 3.314 70 20 CGID CC[C@H](C)N(C)CCN[C@@H]1CCCc2nc(C)sc21 160132204 SLYJTDONJLSXKD-WCQYABFASA-N 281.469 3.149 70 20 CGID O=C(CC[C@H]1CCCO1)N[C@@H]1CCCc2sccc21 160139262 RKJMZYZETKVFEV-DGCLKSJQSA-N 279.405 3.201 70 20 CGID CC(C)NC(=O)N[C@@H](C)Cc1ccccc1Br 160162638 PZHSWJUFLVVHSN-JTQLQIEISA-N 299.212 3.088 70 20 CGID C[C@@H]1CCC[C@H](OCCCCCC(=O)N(C)C)C1 160636637 TYAMZSQQPCINNP-KGLIPLIRSA-N 255.402 3.230 70 20 CGID CCC(=O)c1cccc(NC(=O)c2cc(C(C)=O)c[nH]2)c1 160721583 DUBNUDKQHPPSIG-UHFFFAOYSA-N 284.315 3.062 70 20 CGID Cc1occc1CN(C)C(=O)N[C@@H](C)CC(C)C 160831122 MEFBPOVJZNXQCV-NSHDSACASA-N 252.358 3.164 70 20 CGID COc1ccc(N[C@@H](C)CCn2cccn2)c2cccnc12 159424736 BZGPMCUNRIFDAM-ZDUSSCGKSA-N 296.374 3.331 70 20 CGID C[C@H](NC[C@H](C)N1CCc2ccccc21)c1ccco1 159927484 NOOMFIRROKXLNW-KBPBESRZSA-N 270.376 3.381 70 20 CGID Cc1noc(C)c1C(=O)OCC1=CC[C@H]2C[C@H]1C2(C)C 218496312 NCFAARWXUNHFCS-QWHCGFSZSA-N 275.348 3.441 70 20 CGID CCOc1ccc(CNC(=O)N2CCCC[C@H]2C)cc1 217300880 PNSSKTAHMBUCJA-CYBMUJFWSA-N 276.380 3.169 70 20 CGID Fc1ccc(F)c2c1CCN(Cc1cnc3ccccn13)C2 161440230 JOWYTCHWNFLFJA-UHFFFAOYSA-N 299.324 3.171 70 20 CGID CCN(CC)[C@H](C)CNC(=O)c1ccc2nc(C)ccc2c1 161510116 SVHVHTGPFGWXGU-CQSZACIVSA-N 299.418 3.003 70 20 CGID CCc1nn(C)c(Cl)c1C(=O)N1CC[C@H](C)C[C@H](C)C1 160047111 OCKLLQRQNKEMTE-QWRGUYRKSA-N 297.830 3.144 70 20 CGID CC(C)(C)OC(=O)NCCOc1ccccc1Cl 160059335 AVNBFGXIMARXMN-UHFFFAOYSA-N 271.744 3.244 70 20 CGID CC[C@@H](Nc1nc(C(C)(C)C)ns1)[C@@H]1CCCO1 160117809 XPHBYPDVLRYOGG-ZJUUUORDSA-N 269.414 3.205 70 20 CGID CCn1ccnc1CN1CCC[C@H]1c1cccc(OC)c1 160737685 MFANMBJVYGZWOT-INIZCTEOSA-N 285.391 3.249 70 20 CGID CN(C[C@H]1CCC[C@H]1O)C(=O)NCCCCC(C)(C)C 160787367 JRGCXVMTAIGUHG-ZIAGYGMSSA-N 284.444 3.005 70 20 CGID CCC[C@H](CC)NC(=O)CC(O)(CCC)CCC 160874512 UGHLCRMMGCXCIA-ZDUSSCGKSA-N 257.418 3.403 70 20 CGID COc1ccc(CN(C)Cc2cccc3cn[nH]c23)cc1 159857426 BZWNYOCGFKXSLC-UHFFFAOYSA-N 281.359 3.204 70 20 CGID O=C(NCCc1cccc(O)c1)c1cccc(Cl)c1F 159676166 YWYDPYXHDOSCFP-UHFFFAOYSA-N 293.725 3.157 70 20 CGID O=C(Nc1cnc(C2CC2)nc1)N(CC1CC1)CC1CC1 159589029 PXCLHZKJCLMTFC-UHFFFAOYSA-N 286.379 3.008 70 20 CGID CC[C@H](Nc1ccc2oc(C3CC3)nc2c1)C(=O)OC 159498120 IBPKWFWNNMEEQZ-NSHDSACASA-N 274.320 3.069 70 20 CGID O=C(Nc1ccccc1OC(F)F)N1CCCCC1 160350486 ZWNFBIHZAAMJOY-UHFFFAOYSA-N 270.279 3.306 70 20 CGID COc1ccc(CN[C@H]2CCOC(C)(C)C2)cc1Cl 160429214 IPMOVEIUJJOJHV-LBPRGKRZSA-N 283.799 3.396 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)cc1 161112319 RSAOBSSNCRNSLX-IMJJTQAJSA-N 276.424 3.219 70 20 CGID CCc1ccc(NC(=O)NCCOc2ccccc2)cc1 217303617 XMAOKVVZLCJBBB-UHFFFAOYSA-N 284.359 3.450 70 20 CGID CC(C)CC[C@@H](C)NC(=O)NCCc1ccc(F)cc1 218052433 UVOZUINJXQLYAR-CYBMUJFWSA-N 280.387 3.492 70 20 CGID Cc1c(F)cccc1NC(=O)c1cccc2[nH]cnc12 159775959 KAQNOMULVVIFFY-UHFFFAOYSA-N 269.279 3.263 70 20 CGID Cc1cc(NC(=O)c2cccc(Cl)c2F)sn1 159867705 RIQRJEWPJOBXOZ-UHFFFAOYSA-N 270.716 3.496 70 20 CGID CNC[C@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C 161294791 FXUINKBGIIXIHI-FDRIWYBQSA-N 294.826 3.009 70 20 CGID Cc1cc(C(=O)N(CCC(C)C)CCC(C)C)ncn1 161474722 OAPHCWGGZNQJAQ-UHFFFAOYSA-N 277.412 3.319 70 20 CGID C[C@H](Sc1ccccc1)C(=O)NCC1(C2CC2)CC1 160139458 PDTDDCVHIVPIKD-LBPRGKRZSA-N 275.417 3.474 70 20 CGID Cc1cccc([C@@H](C)NC(=O)C2(N)CCCCC2)c1C 160835820 CLGRFSIKAONUIA-CQSZACIVSA-N 274.408 3.142 70 20 CGID FC(F)(F)COCCN[C@@H]1CCCOc2ccccc21 159363694 CYWROWGMMSMMQR-GFCCVEGCSA-N 289.297 3.069 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCCOCC(C)C 159962259 BKSGQHJPZGFFQC-UONOGXRCSA-N 295.448 3.339 70 20 CGID CCN(C)C(=O)N1CCC(Cc2ccccc2)CC1 160350871 PAMSTPONYOZCCX-UHFFFAOYSA-N 260.381 3.013 70 20 CGID CCCc1sc(C(=O)N(CC)CCCO)cc1CC 160494183 COHUIOOTWQVNAN-UHFFFAOYSA-N 283.437 3.108 70 20 CGID CCC(CC)(CN)C(=O)Nc1cccc(C(F)F)c1 161207566 JWXWOFDKRQBWDF-UHFFFAOYSA-N 270.323 3.328 70 20 CGID CC[C@H](C)N(CCCCS(C)(=O)=O)Cc1ccccc1 161224274 MYJJHBKOOZRUIN-HNNXBMFYSA-N 297.464 3.112 70 20 CGID CN(Cc1cccc(F)c1)Cc1cnn(C(C)(C)C)c1 160473020 FBOMHZMKSMKRKO-UHFFFAOYSA-N 275.371 3.409 70 20 CGID O=C(NCc1ccc(CO)cc1)Nc1ccccc1Cl 217275573 QQIBSMKALIDVHP-UHFFFAOYSA-N 290.750 3.154 70 20 CGID CC(C)CNC(=O)N1C[C@@]2(C)C[C@H]1CC(C)(C)C2 217269508 NVUIPYNTHLCOLX-DOMZBBRYSA-N 252.402 3.253 70 20 CGID O=C(CNc1ccccc1)N[C@@H]1CCC[C@H](C2CC2)C1 161026771 VLAYEVVTMUCTGB-GOEBONIOSA-N 272.392 3.184 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c(F)c1 161035418 WJUPYKQVDGRYDQ-WFASDCNBSA-N 292.354 3.213 70 20 CGID CCCCNc1ccccc1C(=O)NCc1ccccn1 161335132 FQAHNFWUNRSVJC-UHFFFAOYSA-N 283.375 3.224 70 20 CGID CCOCCC1(CNC(=O)NCc2ccccc2C)CC1 161383601 FWRYYCBAZAJCCV-UHFFFAOYSA-N 290.407 3.001 70 20 CGID O=C(COc1ccc(Cl)cc1)NCC1(C2CC2)CC1 160084313 HWWJEUWSKMGXPV-UHFFFAOYSA-N 279.767 3.025 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H]1CCCOc2ccccc21 160123956 AJACHZJGYRVYPG-GDBMZVCRSA-N 276.424 3.220 70 20 CGID O=C1CCCN1c1ccc(S(=O)(=O)NCC2(C3CC3)CC2)cc1 160208174 NXYQJBZGOHAAQP-GFCCVEGCSA-N 334.441 2.282 70 20 CGID CC[C@H](NCCOc1cccc(Cl)c1)c1cnn(C)c1 160250686 YQUZFZBMKHDMAY-HNNXBMFYSA-N 293.798 3.193 70 20 CGID CCC(N)(CC)CNC(=O)C1(c2cccc(Cl)c2)CC1 160414853 NXYUBLBYJHVVAE-UHFFFAOYSA-N 294.826 3.005 70 20 CGID C[C@H](C(=O)NCCc1ccco1)c1c(F)cccc1F 160558686 SDLVRFPSFVGGGB-JTQLQIEISA-N 279.286 3.020 70 20 CGID CC(C)c1csc(CNC(=O)NCC2(C3CC3)CC2)n1 160565938 WXURXIOEPSCARY-UHFFFAOYSA-N 293.436 3.256 70 20 CGID CCCC1(CNC(=O)[C@H](OC)c2ccccc2)CC1 160679111 GUJKTAZAZURJQO-CQSZACIVSA-N 261.365 3.071 70 20 CGID CC[C@H](NC1CCN(C(=O)OC)CC1)c1ccc(F)cc1 160819543 RDUHRSZGXLVKEI-HNNXBMFYSA-N 294.370 3.097 70 20 CGID CCCCN(Cc1nncn1C)[C@H](C)c1ccccc1 160871628 FCVYZLSVIHRDRX-CQSZACIVSA-N 272.396 3.178 70 20 CGID CC[C@H](C)[C@H](NCc1ccc(C)cn1)C(=O)OC(C)(C)C 160950518 MDIZJIAZMMFBHK-ZFWWWQNUSA-N 292.423 3.236 70 20 CGID O=C(CC1CCSCC1)N[C@@H]1CCOC2(CCCC2)C1 159664206 KNZGWQJFGSKPKK-CQSZACIVSA-N 297.464 3.128 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc2c(c1)CCC2 159972283 UUBKEBPKSSGMNG-UHFFFAOYSA-N 255.361 3.095 70 20 CGID COc1cc2c(cc1OC)CN(Cc1occc1C)CC2 159780002 PTPCZHPKEBHFRC-UHFFFAOYSA-N 287.359 3.164 70 20 CGID CC[C@H](C)[C@@H](C(=O)N(CC)CCCO)c1ccccc1 160485604 JNTNXQLSTDPCBT-GOEBONIOSA-N 277.408 3.047 70 20 CGID CCOCCC1(C(=O)Nc2cccc(F)c2)CCC1 161039544 AGEZUELLDQNFLZ-UHFFFAOYSA-N 265.328 3.361 70 20 CGID Cc1ccc(NC(=O)N2C[C@@H](C)CCC[C@@H]2C)cn1 161329574 KWFSDTCANCXTGZ-AAEUAGOBSA-N 261.369 3.432 70 20 CGID C[C@@H](C(=O)N(CCN(C)C)C1CCCC1)c1ccsc1 160059971 LKOKZKLELIXKED-CYBMUJFWSA-N 294.464 3.184 70 20 CGID CCOCCC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 160141084 AVRZLVIZOGZYMX-GOSISDBHSA-N 298.386 3.022 70 20 CGID Cc1cc(C(=O)N(C)c2ccc3c(c2)OCO3)ccc1F 160534130 JDWPCMSCSWYVQU-UHFFFAOYSA-N 287.290 3.139 70 20 CGID CC[C@H](NC[C@H]1CCCO1)c1ccc(F)cc1F 160652298 XRUSSEDDCHQNIE-RISCZKNCSA-N 255.308 3.185 70 20 CGID C[C@H](c1nc([C@@H]2CCOC2)no1)c1c(F)cccc1F 160888603 PUMGLZKWTWVOFZ-DTWKUNHWSA-N 280.274 3.004 70 20 CGID CCc1ccc([C@H](C)N[C@H](C(=O)OC)[C@H](C)CC)cc1 218058384 XWXRULOYNUERHL-WWGRRREGSA-N 277.408 3.487 70 20 CGID CCCC1(CN[C@@H](C(=O)OC)c2ccccc2)CC1 160774103 ZQISVCHAOCNORN-CQSZACIVSA-N 261.365 3.071 70 20 CGID CCN(CCCO)C1c2ccccc2-c2ccccc21 161434398 GIIQKAIAMLRMCT-UHFFFAOYSA-N 267.372 3.461 70 20 CGID CCCCN1CCOc2cc(Br)ccc21 217240223 XXVNQSHDYHCQSF-UHFFFAOYSA-N 270.170 3.448 70 20 CGID CO[C@H]1CCCC[C@H]1Nc1nc(C(C)(C)C)ns1 159674619 IJIAYVAGJAGLRO-ZJUUUORDSA-N 269.414 3.205 70 20 CGID CCCSc1nc2ccc(F)cc2c(=O)n1CC 159840510 CVXKVOJTTDLXPW-UHFFFAOYSA-N 266.341 3.058 70 20 CGID C[C@H](NC(=O)C[C@H]1CCCCC1(C)C)C(=O)NC(C)(C)C 161095775 UNQZIALQKOOLGT-QWHCGFSZSA-N 296.455 3.012 70 20 CGID Cc1ccc(C(=O)Nc2[nH]nc(-c3ccc(C)o3)c2C)cn1 161360866 FUEIQCHXZNFZMB-UHFFFAOYSA-N 296.330 3.242 70 20 CGID Cc1cccc(C(=O)N(C)C2CCN(C(C)C)CC2)c1F 161431678 QQHRNBMOMASISP-UHFFFAOYSA-N 292.398 3.079 70 20 CGID CCN(C(=O)C[C@@H](C)c1ccncc1)c1cccnc1 160385634 QWODPWRDRVATCT-CYBMUJFWSA-N 269.348 3.023 70 20 CGID CCCC1(CNC(=O)CSCc2ccccn2)CC1 160623257 FISFHKVLMYQCAD-UHFFFAOYSA-N 278.421 3.011 70 20 CGID Fc1cccc(CN(CCOCC2CC2)C2CC2)c1 159400397 RMFLHMGNEMBJCM-UHFFFAOYSA-N 263.356 3.217 70 20 CGID C[C@H](CCn1cccn1)Nc1ccc(-n2ccnc2)c(F)c1 159424456 PCCSYXYCHBEGIJ-CYBMUJFWSA-N 299.353 3.099 70 20 CGID Cc1cc(NC(=O)C[C@H]2C[C@@H](C)CC(C)(C)C2)c[nH]c1=O 159650541 GLHXAOZVCGKUCT-DGCLKSJQSA-N 290.407 3.474 70 20 CGID COc1cc(C)ccc1CN[C@H](C)c1ccccn1 159364906 ZQPMQGGDAVNWOC-CYBMUJFWSA-N 256.349 3.249 70 20 CGID COCCN(C)CCN[C@H](CC(C)C)c1cccs1 159389545 SXAJBVYUQLPQMK-CQSZACIVSA-N 284.469 3.003 70 20 CGID CS[C@@H](C)CC(=O)Oc1ccc(NC(=O)C2CC2)cc1 159988211 NLCXTMIWIRCQAZ-JTQLQIEISA-N 293.388 3.082 70 20 CGID Cc1ccnc(N[C@@H]2CCCc3cc(N)ccc32)c1 159493482 DFARPXJDOWTACF-OAHLLOKOSA-N 253.349 3.462 70 20 CGID CC1(C)CC[C@H](COC(=O)c2cccc(Cl)c2N)O1 160792704 MUBRNYQZMXFECS-SECBINFHSA-N 283.755 3.037 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1nc(C)ncc1Cl 161076806 KGTSALAFUASCTM-AAEUAGOBSA-N 295.814 3.479 70 20 CGID CCCCn1ncc(NC(=O)N2CCC3(CCC3)C2)c1C 160008528 LKJYDCVFLAMIJU-UHFFFAOYSA-N 290.411 3.400 70 20 CGID Clc1cc(N[C@@H]2CCO[C@@H](C3CC3)C2)ccn1 160299990 SEUJDUXDPQZMOB-VXGBXAGGSA-N 252.745 3.105 70 20 CGID O=C(CCc1ccccn1)Nc1cccc(OCCF)c1 160480817 BGMPUPXTJRKECR-UHFFFAOYSA-N 288.322 3.001 70 20 CGID Cc1ccc([S@](=O)Cc2nccs2)c(C)c1 160632322 IXSZCHXQKOPZKG-INIZCTEOSA-N 251.376 3.068 70 20 CGID CC(C)(C)NC(=O)NCC1(c2ccccc2Cl)CC1 160649869 YBPGMAIJMAXHRZ-UHFFFAOYSA-N 280.799 3.469 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CCCCOC 160829143 GTWHXZUFBLVGPN-KBPBESRZSA-N 255.402 3.230 70 20 CGID CCC(C)(CC)C(=O)NCCOCc1ccc(OC)cc1 159421443 DBSPQJBLAXYTLO-UHFFFAOYSA-N 293.407 3.154 70 20 CGID C[C@@H](O)C[C@@H]1CCCCN1CCCc1ccccc1 159981197 PYUXLTSCNVWTBE-WBVHZDCISA-N 261.409 3.245 70 20 CGID Cc1cccc(CC[C@H](C)NCC2(CO)CCCC2)c1 160122982 CVHCLUPRPLEOMP-INIZCTEOSA-N 275.436 3.458 70 20 CGID CCCCn1ncc(C(=O)N[C@H]2CCC[C@@H](C)C2)c1C 161054065 LVGSNYCWXDRBBV-OCCSQVGLSA-N 277.412 3.300 70 20 CGID COc1ccc(COCCCN[C@@H](C)C(C)C)cc1 161070935 DKLFGDOWGXLPSC-AWEZNQCLSA-N 265.397 3.236 70 20 CGID COc1cc(F)c(C(=O)Nc2ccc(F)cc2)cc1OC 161143492 AKJNZPGLLOBQHA-UHFFFAOYSA-N 293.269 3.234 70 20 CGID C[C@@H]1Sc2ccccc2N(CC[C@@H]2CCOC2=O)[C@@H]1C 161161524 KKEQVRQZBSPNLN-FRRDWIJNSA-N 291.416 3.329 70 20 CGID CC[C@H](C(=O)NCCCOC(C)C)c1ccc(F)cc1 160012672 YGADUGMUKQOUCX-HNNXBMFYSA-N 281.371 3.251 70 20 CGID C[C@@H](N[C@H](C)C1CC1)c1ccc(OCc2nccn2C)cc1 160118489 WUJDHRVYFBXOND-ZIAGYGMSSA-N 299.418 3.448 70 20 CGID CCN(C(=O)N[C@H]1CCO[C@@H](C2CC2)C1)C1CCCCC1 160428229 LHNKRBQOHGUICH-GOEBONIOSA-N 294.439 3.308 70 20 CGID Cc1ccc2cc(C(=O)N3C[C@H](C)OC(C)(C)C3)ccc2n1 160489828 FBVTXKBKTGFNOE-ZDUSSCGKSA-N 298.386 3.183 70 20 CGID Cc1ccc(Cc2nc(C(=O)NCCCF)cs2)cc1 160611787 VWLIEJZOVQRSCP-UHFFFAOYSA-N 292.379 3.132 70 20 CGID CC(C)(C)c1nsc(Nc2ccn(CC(F)F)n2)n1 159834983 YVWMLEXMHQEMGP-UHFFFAOYSA-N 287.339 3.041 70 20 CGID CC(C)CCn1ccc(NC(=O)NC2CCCCC2)n1 159524853 QDTOQPDEVWCEOF-UHFFFAOYSA-N 278.400 3.383 70 20 CGID CCc1noc(C)c1CSCc1nc(C2CC2)no1 159720055 SBUNPJHMBCVQHI-UHFFFAOYSA-N 279.365 3.239 70 20 CGID CCCCNC(=O)CCSCc1c(CC)noc1C 159981140 NQPYUPWQFKVSER-UHFFFAOYSA-N 284.425 3.085 70 20 CGID CCCn1nccc1CNCc1ccccc1OC(F)F 159981690 BOFIGZNHKYPTOX-UHFFFAOYSA-N 295.333 3.184 70 20 CGID COC(=O)c1occc1CN1c2ccccc2CC[C@@H]1C 216892708 WVUZQACINWOQDV-LBPRGKRZSA-N 285.343 3.408 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@@H]1CC1(Cl)Cl 160100462 YCVPZMRWZGPNQH-IUCAKERBSA-N 290.215 3.436 70 20 CGID CC(C)CNC[C@@H]1CCCCN1C(=O)OC(C)(C)C 218096019 VVEUQGUJPRMMSO-ZDUSSCGKSA-N 270.417 3.022 70 20 CGID CCC[C@H](C)N(C)C(=O)c1cccc(Br)n1 217717208 AUPSUTAABNBMIQ-VIFPVBQESA-N 285.185 3.105 70 20 CGID COc1cc(F)c(NC(=O)N(C)CCC2CC2)cc1F 160165359 JQBWJOVPRNQGCI-UHFFFAOYSA-N 284.306 3.237 70 20 CGID COc1ccc(N(C)C(=O)C2CCC2)cc1Cl 160255735 MNZWZJVTZALBST-UHFFFAOYSA-N 253.729 3.112 70 20 CGID CC[C@@H](CC(=O)NCCCC(C)(C)CO)c1ccccc1 160358651 CLRDQWWJAJPYIX-HNNXBMFYSA-N 291.435 3.485 70 20 CGID CC[C@@H](C)OCC(=O)Nc1cc(NC(C)=O)ccc1Cl 160466632 CAJVMVROZACOOM-SECBINFHSA-N 298.770 3.052 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cc(C)no1 160780931 PQXFVVSYHRYLKL-NWDGAFQWSA-N 250.342 3.024 70 20 CGID COC(=O)c1cc(CN[C@H]2CCCc3sccc32)c[nH]1 160982940 YDQVOGKBJHTAQK-LBPRGKRZSA-N 290.388 3.030 70 20 CGID C[C@H](CC1CCOCC1)NC1CC(C)(C)NC(C)(C)C1 159640177 FKZCNYKPYUSJIJ-CYBMUJFWSA-N 282.472 3.090 70 20 CGID C[C@H](OCCCNC(=O)C1(C)CC1)c1ccccc1 159700361 IEZLZJIPHGYFBV-ZDUSSCGKSA-N 261.365 3.071 70 20 CGID Cc1ocnc1C(=O)N1C[C@H](C)CSc2ccccc21 159564849 RLZRCQYNZMPHPB-JTQLQIEISA-N 288.372 3.372 70 20 CGID CCOc1ccc([C@@H](C)N[C@@H](CC)COC)cc1OC 159975203 HZEZJPUVOLJNFB-OCCSQVGLSA-N 281.396 3.170 70 20 CGID CCCCCNC(=O)CSCc1c(CC)noc1C 159983541 SBJGXHGLDILSFG-UHFFFAOYSA-N 284.425 3.085 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1ccc(OC)cc1 160138174 RMWMWJKVBOCCGH-KBPBESRZSA-N 264.413 3.076 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cc(F)cc(F)c1 160111923 AQSLFMFPYNQDBF-RYUDHWBXSA-N 270.367 3.346 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cc(F)cc(F)c1 161079843 JITPDQUFQWLWEL-XZJROXQQSA-N 282.378 3.488 70 20 CGID O=C(CCC1CCCC1)Nc1ccc(S(=O)(=O)F)cc1 864237659 BVANPJLZPMUUDZ-UHFFFAOYSA-N 299.367 3.254 70 20 CGID O=S(=O)(Cl)C(c1ccccc1)c1ccccc1 60008428 WUAUXPDYAQKEKT-UHFFFAOYSA-N 266.749 3.345 70 20 CGID CCOC(=O)[C@@H](c1ccccc1)N(C)Cc1ccccc1 217671188 OHLDOFYGKKOKIC-QGZVFWFLSA-N 283.371 3.423 70 20 CGID CCc1noc(C)c1C[S@](=O)c1ccc(C)cc1C 161040347 MEYAMKFVWBZAOF-LJQANCHMSA-N 277.389 3.470 70 20 CGID O=C(C1CC=CC1)N(Cc1ccccc1)CC1(O)CCCC1 161160302 BPUDQQULTOIDSZ-UHFFFAOYSA-N 299.414 3.287 70 20 CGID CC[C@H](C)[C@H](N)C(=O)N(C)c1ccc(C(C)C)cc1 161460722 ZARUKFIPDWAOGU-WFASDCNBSA-N 262.397 3.146 70 20 CGID Cc1cc(C(=O)NCCC[C@H]2CCCCO2)cc(Cl)n1 160542702 HKTQXZNJKBEJDE-CYBMUJFWSA-N 296.798 3.123 70 20 CGID CCC(C)(C)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160604873 QOLHNMHUGGAZTN-CYBMUJFWSA-N 267.413 3.421 70 20 CGID CCCCCN(C(=O)N[C@H]1CCN(CC2CC2)C1)C(C)C 160691355 ZLPQAVOCBUTGQN-INIZCTEOSA-N 295.471 3.081 70 20 CGID CC(C)[C@H](NCc1nnc2n1CCCCC2)c1ccccc1 160718304 SDQHCJFGVXDDEJ-SFHVURJKSA-N 298.434 3.491 70 20 CGID C[C@H](CC(=O)N1CCC[C@@H]2CCC[C@@H]21)c1ccncc1 160851985 MJKUQLOTYIXZOH-KBMXLJTQSA-N 272.392 3.366 70 20 CGID CN(C)c1ccncc1CN[C@@H]1CCCc2sccc21 160993678 MOIBMSTVEDDBGQ-CQSZACIVSA-N 287.432 3.376 70 20 CGID CC[C@@H](C(=O)NCc1scnc1C)c1ccc(F)cc1 159808575 ULXOFWUCHZPMHU-CYBMUJFWSA-N 292.379 3.401 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(Br)cn1 159877999 FSCLVZLNEIKKDG-BXKDBHETSA-N 283.169 3.219 70 20 CGID CC[C@@H](Nc1ccc2oc(C3CC3)nc2c1)C(=O)OC 159498259 IBPKWFWNNMEEQZ-LLVKDONJSA-N 274.320 3.069 70 20 CGID CNCC[C@H]1CCCCN1C(=O)c1cccc(C)c1Cl 160393896 PNBZEUZJEIHYQP-CYBMUJFWSA-N 294.826 3.253 70 20 CGID CCOc1ccc(CNC(=O)N2CCc3ccccc32)cc1 217301000 YRQBREJXTYOYRH-UHFFFAOYSA-N 296.370 3.358 70 20 CGID CC(C)CCOC(=O)c1ccc(Br)o1 217479479 OKUQRJCDKGCRCG-UHFFFAOYSA-N 261.115 3.245 70 20 CGID COCCN(Cc1ccccc1)Cc1cccc(O)c1 160450021 NVPNEVNARVQDPB-UHFFFAOYSA-N 271.360 3.041 70 20 CGID C[C@H](OC(=O)c1cc(F)cc(N)c1F)c1ccccc1 217925576 HAQNBEOFPQDNEQ-VIFPVBQESA-N 277.270 3.465 70 20 CGID CCc1nnsc1C(=O)N(C)[C@@H]1CCCC[C@@H]1CC 161040844 WQNBSKFGXXPAHT-CMPLNLGQSA-N 281.425 3.141 70 20 CGID CC1(C)CCC(CC(=O)NC[C@@H]2CCCCO2)CC1 161259441 QEAKCVZJBZEMIQ-AWEZNQCLSA-N 267.413 3.278 70 20 CGID CCOC[C@@H](O)CN[C@@H](CC(C)C)c1ccccc1C 161378279 AAJPCVMATXGNCY-RDJZCZTQSA-N 279.424 3.069 70 20 CGID Cc1cc(CNC(=O)C[C@@H]2CCCCC2(C)C)on1 161433366 OQMJHSYNZPADQP-LBPRGKRZSA-N 264.369 3.206 70 20 CGID COCCCCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160156066 GPLNRORZFFTBMO-LBPRGKRZSA-N 291.269 3.045 70 20 CGID C[C@H](CC(=O)NCC1(C)CCCC1)c1ccncc1 160501082 ZFXYXRXQVUUBTG-CYBMUJFWSA-N 260.381 3.272 70 20 CGID CC(C)c1nc(CCNC(=O)NC2(C)CCC2)cs1 160530667 HTSMUANASWKNOS-UHFFFAOYSA-N 281.425 3.051 70 20 CGID CCN(Cc1cccnc1C)C[C@@H]1COc2ccccc2O1 160955203 XXRLRTJSWCWTDS-MRXNPFEDSA-N 298.386 3.052 70 20 CGID Cc1cccc(NC(=O)c2ccn(C3CCCC3)n2)c1O 159878121 VYJVAOYAEHIKDU-UHFFFAOYSA-N 285.347 3.265 70 20 CGID Cc1cc(C)cc(CCC(=O)NCCc2cccc(O)c2)c1 159746265 PHTNSQTWNIGXAD-UHFFFAOYSA-N 297.398 3.301 70 20 CGID C[C@@H](NC(=O)Nc1ccn(-c2ccccc2)n1)C1CCC1 159766610 RIILWEUDJRLBCF-GFCCVEGCSA-N 284.363 3.182 70 20 CGID COc1ccc([C@H](C)NC[C@@H]2CCC(C)(C)O2)cc1 160310232 WITLAQFFODSSDJ-WFASDCNBSA-N 263.381 3.303 70 20 CGID O=C(NCCC12CC3CC(CC(C3)C1)C2)[C@H]1CCCOC1 216721496 RURDYHNABWSCBT-KUNBBXKYSA-N 291.435 3.136 70 20 CGID Cc1c(C(=O)N[C@H]2CCC[C@@H](N)C2)oc2c(C)cccc12 161063554 MSWIBFBJDRVHHY-OLZOCXBDSA-N 286.375 3.049 70 20 CGID CCc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2 161092938 BZDRWLUYZGVCTE-UHFFFAOYSA-N 283.327 3.273 70 20 CGID CC(C)CN1CC[C@H](CNC(=O)C2CCC(C)(C)CC2)C1 161168202 ZIFDRQVQUZXBBZ-OAHLLOKOSA-N 294.483 3.297 70 20 CGID CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1C[C@]1(C)CC 160025349 ICXRCLZMHCSJRZ-DYVFJYSZSA-N 289.375 3.200 70 20 CGID CC(C)C[C@H](C)NC(=O)NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 160719360 GXDNKDVPZDKVKU-DXEWXGHRSA-N 286.419 3.306 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccccc1O 160851976 XUBVCYOTPANCLD-CYBMUJFWSA-N 289.375 3.004 70 20 CGID CCCCn1ncc(C(=O)Nc2cccc(C(C)=O)c2)c1C 159469833 HRMMNZAJRQWDSH-UHFFFAOYSA-N 299.374 3.447 70 20 CGID Cc1ccc([C@H]2CCCCN2C(=O)[C@@H]2CCCNC2)cc1 159913454 WJYFXUMTEXSULR-IAGOWNOFSA-N 286.419 3.048 70 20 CGID O=C([C@@H]1CCCCO1)N(Cc1ccccc1)Cc1ccco1 159939058 CPSMUFQDNPHNCW-KRWDZBQOSA-N 299.370 3.378 70 20 CGID C[C@@H]1CCN(C(=O)c2ccnc(F)c2)[C@@H]2CCCC[C@@H]12 217583058 IALUHCDMPVPHBC-KWCYVHTRSA-N 276.355 3.262 70 20 CGID Cc1cc(NC(=O)[C@H](C)Cc2ccc(Cl)cc2)nn1C 161171674 AOSPHERKCLHKMI-SNVBAGLBSA-N 291.782 3.199 70 20 CGID C[C@@H]1Sc2ccccc2N(CCn2cccn2)[C@H]1C 161184616 GXMKCUGSRNSTQG-STQMWFEESA-N 273.405 3.272 70 20 CGID CC[C@@H](SCCCS(C)(=O)=O)c1ccc(F)cc1 161330147 BWXMVKWAFKHAIQ-CYBMUJFWSA-N 290.425 3.445 70 20 CGID CC1(NC(=O)NCC(C)(C)c2cccc(F)c2)CCC1 161358687 OJSOSRUDFZZCST-UHFFFAOYSA-N 278.371 3.345 70 20 CGID O=C(C[C@@H]1CSCCS1)N1CCC[C@H]1C1CCCC1 160251587 YHOQRAYEWUOFQF-KGLIPLIRSA-N 299.505 3.406 70 20 CGID CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccnn1C(C)C 160521720 LIDVXGIAERZHPC-KGLIPLIRSA-N 294.443 3.159 70 20 CGID Cc1cnc(C)c(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160630496 MAGNVFOYSBEVAH-CVEARBPZSA-N 283.375 3.426 70 20 CGID Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cccnc2O)c1 160682672 DFMWTTRNHDFGAF-INIZCTEOSA-N 296.370 3.381 70 20 CGID CSc1cc(C(=O)NCCCSCC(C)C)ccn1 160697280 XOHZBRBXKZKWEB-UHFFFAOYSA-N 298.477 3.313 70 20 CGID CCOCc1cccc(N[C@@H](C)C(=O)OC(C)(C)C)c1 160867232 LCSITRWKNCPSHD-LBPRGKRZSA-N 279.380 3.365 70 20 CGID C[C@H](N)C(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 160981916 PPAXEHUQKMYAGL-FZMZJTMJSA-N 280.799 3.131 70 20 CGID O=C(CC1=CCCCC1)N[C@@H]1CCOC2(CCCC2)C1 159429182 RERHRYDQUKFYCT-OAHLLOKOSA-N 277.408 3.485 70 20 CGID O=C(NCCc1cscn1)N1CCC[C@@H]1C1CCCC1 159438439 AXHIRROXMFQTDG-CQSZACIVSA-N 293.436 3.050 70 20 CGID C[C@H](O)C[C@@H](CNC(=O)c1cccs1)c1ccccc1 159777763 LAJIDUAWXOSYCH-JSGCOSHPSA-N 289.400 3.033 70 20 CGID COc1ccc([C@H](O)CNC[C@@H]2CCCC[C@@H]2C)cc1 218437535 BTCAGVSYAPNFMX-JLJPHGGASA-N 277.408 3.145 70 20 CGID C[C@@H](N[C@@H]1CCC[C@@H](N)C1)c1ccc(Br)cc1 160029463 LLDBEDBLOOXQFK-LERXQTSPSA-N 297.240 3.370 70 20 CGID CC(C)(CCO)NC(=O)c1cc2c(s1)CCCCCC2 161495118 FJWLGQXXQVYOAW-UHFFFAOYSA-N 295.448 3.298 70 20 CGID C[C@@H]1CC=CC[C@H]1COC(=O)c1ccc2c(c1)CCC(=O)N2 216788844 BKFDKSGKPIRPEP-DOMZBBRYSA-N 299.370 3.330 70 20 CGID CCCCCOC[C@H](CS(=O)(=O)Cl)C(C)C 114477016 ISFDCJDYZQSTSQ-LLVKDONJSA-N 270.822 3.034 70 20 CGID NC(=O)c1ccc(CNc2cc(F)cc(Cl)c2)cc1 217528078 VKYPWIVMHOQNAL-UHFFFAOYSA-N 278.714 3.190 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H](C)C2CC2)n1 161263299 FEWJTPVXCOYNQB-JTQLQIEISA-N 284.363 3.019 70 20 CGID CC(=O)NCCCSCc1c(C)cccc1C 161326612 SFGNNULULDNKCV-UHFFFAOYSA-N 251.395 3.063 70 20 CGID C[C@H](N(C)C(=O)C[C@@H](C)c1ccncc1)C1(C)CC1 161418978 SJUJUSIALIVUSG-OLZOCXBDSA-N 260.381 3.222 70 20 CGID CC[C@H](NC1CCN(C)CC1)c1cc(Cl)ccc1OC 161437629 BJTYSHNLFQQBMB-HNNXBMFYSA-N 296.842 3.484 70 20 CGID C[C@@H](NC[C@H](C1CCCCC1)N(C)C)c1cncc(F)c1 160412834 IHODBVOJARANFT-CXAGYDPISA-N 293.430 3.382 70 20 CGID CS[C@H](C)CC(=O)Nc1cnn(Cc2ccccc2)c1 160522282 IRAHUNPDSISVIK-GFCCVEGCSA-N 289.404 3.012 70 20 CGID CCN1CCCN(C(=O)NC(CC(C)C)CC(C)C)CC1 159819757 BDZUEOJDKZODJB-UHFFFAOYSA-N 297.487 3.184 70 20 CGID O=C(Nc1ccccc1N1CCCCC1)[C@@H]1CCCCO1 159566407 PLDUEPOPBXXQHN-INIZCTEOSA-N 288.391 3.185 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)CSCc1ccncc1 159595655 QZVWOMZLYHQWNQ-KGLIPLIRSA-N 278.421 3.010 70 20 CGID CCC[C@@H](C(=O)Nc1c[nH]c(=O)c(C)c1)c1ccccc1 159599091 MZBWDTFTOYIGRC-OAHLLOKOSA-N 284.359 3.206 70 20 CGID C[C@@H]1Cc2ccccc2N1C[C@@H](O)Cc1ccccc1 218671770 BLIDSAAHWBXNBU-PBHICJAKSA-N 267.372 3.041 70 20 CGID C[C@@H](CC(=O)N[C@H]1CCCC1(C)C)c1ccncc1 161295036 MBMLEZGVBFUWJU-JSGCOSHPSA-N 260.381 3.270 70 20 CGID CCCNC(=O)CN[C@H](CC)c1cccc(Cl)c1F 161504048 NIRKZEURFQPIFK-GFCCVEGCSA-N 286.778 3.046 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cc(C)ccc1F 160027469 YJKNJPUDVHFXDT-UHFFFAOYSA-N 282.359 3.054 70 20 CGID Cc1cccc([C@@H](NC(=O)C2CCC2)c2ccccn2)c1 160057897 FZDXWWNWANXCEE-QGZVFWFLSA-N 280.371 3.396 70 20 CGID CCn1nccc1CNc1cc(NC(=O)C2CC2)ccc1C 160062475 UUFXIEHEOBHSEY-UHFFFAOYSA-N 298.390 3.172 70 20 CGID CC[C@H](NC(=O)C(C)(C)CC)c1c(C)noc1C 160505589 JCYZMKSBPNKBGM-NSHDSACASA-N 252.358 3.295 70 20 CGID CCCCc1noc(CSCCc2c(C)noc2C)n1 160124982 FTEHFPWHVCPRHJ-UHFFFAOYSA-N 295.408 3.493 70 20 CGID CCCO[C@@H]1CCCN(Cc2cnc3ccccn23)CC1 160275633 ACKFNGMXISEKHO-MRXNPFEDSA-N 287.407 3.115 70 20 CGID CCC(CC)NC(=O)Nc1ccn(CCC(C)C)n1 160348557 NQFURHUQOLTVID-UHFFFAOYSA-N 266.389 3.239 70 20 CGID CCCCNc1ccccc1C(=O)N1C[C@H](C)O[C@H](C)C1 160489178 AKUJGRXDOAQTTR-OKILXGFUSA-N 290.407 3.148 70 20 CGID Cc1cc(NC(=O)[C@@H](Cc2ccccc2)C(C)C)c[nH]c1=O 159811698 ZXACZOXLJQVKCN-INIZCTEOSA-N 298.386 3.137 70 20 CGID CC(C)(F)C(=O)NCC1(Cc2ccccc2)CCC1 159833683 DJTCIMUHSIITKD-UHFFFAOYSA-N 263.356 3.264 70 20 CGID CCn1nccc1CN[C@@H](c1ccc(OC)cc1)C(C)C 159907419 RVOPVWMDPDCIHC-QGZVFWFLSA-N 287.407 3.399 70 20 CGID CCOC(=O)CN(C)[C@@H](C)c1ccc(F)c(Cl)c1 159516601 LXLTUNPCAZXOKP-VIFPVBQESA-N 273.735 3.035 70 20 CGID CCc1noc(C)c1CNc1cccc(NC(C)=O)c1C 159371997 OQDIJXHMVFJMEI-UHFFFAOYSA-N 287.363 3.424 70 20 CGID COCCC1(CN[C@H](C)c2ccccn2)CCCC1 159376340 PCHLNXRAOJRLCO-CQSZACIVSA-N 262.397 3.329 70 20 CGID C[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccc(F)c1 218437193 UVXXNUQEDVBUJC-XNRPHZJLSA-N 265.372 3.275 70 20 CGID C1CCN(CCCN2CCC[C@@H]2C2CCC2)CC1 160886392 PLYKFVNOZOYHIY-MRXNPFEDSA-N 250.430 3.127 70 20 CGID Cc1ccc(C(=O)CCN(C)CCc2nccs2)cc1 161014724 CNXILRQLTQPXFK-UHFFFAOYSA-N 288.416 3.199 70 20 CGID Cc1csc(NC(=O)N2CC[C@@H]3CCCC[C@@H]32)n1 160043872 LEOPSCHDWMHWCB-QWRGUYRKSA-N 265.382 3.248 70 20 CGID O=C(NOCc1cccnc1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 161040727 NSBSHOTXLWABEO-ARFHVFGLSA-N 288.391 3.236 70 20 CGID CCCC(=O)N1CC[C@H](Oc2ccccc2Cl)C1 161246783 BPFRVLYDULZIKD-NSHDSACASA-N 267.756 3.120 70 20 CGID COc1ccc(COCCC(=O)N2[C@@H](C)CC[C@H]2C)cc1 161505709 HPEZWGAKSPLGKI-OKILXGFUSA-N 291.391 3.001 70 20 CGID CC(C)C[C@@H](C)OCCC(=O)NCC1(C2CC2)CC1 160088721 KXJLDKLJTAZWNF-CYBMUJFWSA-N 267.413 3.134 70 20 CGID CC(C)(C)c1nsc(N[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)n1 160102381 WSRFLGZQBPLAKY-DCAQKATOSA-N 293.436 3.205 70 20 CGID C[C@H](N[C@H](C)C1CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 160114328 AMIFLALTFUEZQU-MNOVXSKESA-N 272.392 3.365 70 20 CGID CCC[C@H](C(=O)Nc1ccn(CC(F)F)n1)C(C)C 160153244 FYKGRXQWAZHJQD-JTQLQIEISA-N 273.327 3.159 70 20 CGID C[C@@H]1CCC[C@H](N(C)C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C1 160303401 WOXTZBPSQOLBLO-OJLVUWQFSA-N 294.439 3.164 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CCCCOC 160829003 GTWHXZUFBLVGPN-KGLIPLIRSA-N 255.402 3.230 70 20 CGID Cn1ccnc1CN(C1CC1)[C@@H]1CCc2ccccc21 160835104 BKZYLNRLKGGZMY-MRXNPFEDSA-N 267.376 3.072 70 20 CGID COc1ccc2c(c1)[C@H](N[C@H](CCO)c1ccccc1)CC2 160987071 QMTQHDGIGLDLHI-RTBURBONSA-N 297.398 3.396 70 20 CGID Cc1cc(C)c(C(=O)Nc2cccc(OCCF)c2)[nH]1 159411500 IAAFBWMTCDFMLD-UHFFFAOYSA-N 276.311 3.232 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)NCCc1cscn1 159443854 NMYQCEBHCMWOJQ-OCCSQVGLSA-N 295.452 3.296 70 20 CGID C[C@H](CC(=O)NCCCOc1ccccc1)c1ccncc1 159476448 DPFQFWSBXSRWSY-OAHLLOKOSA-N 298.386 3.161 70 20 CGID CNC(=O)c1cccc(NC(=O)Nc2cscc2C)c1 159944681 OZUGHQDFNVBOSE-UHFFFAOYSA-N 289.360 3.060 70 20 CGID CN(c1ccccc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 218259359 CLDQRAFQFVRRFB-CQSZACIVSA-N 276.380 3.132 70 20 CGID Clc1ccccc1CCNC1CCC2(CC1)OCCO2 161383585 TUVCQRNAEAYORW-UHFFFAOYSA-N 295.810 3.158 70 20 CGID CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)CCCN 160079790 NJVXHSVMRBEYIU-OAHLLOKOSA-N 282.815 3.234 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCCO1)c1ccc(Cl)s1 161201406 MXAUGWIKYPLPIW-RKDXNWHRSA-N 273.785 3.148 70 20 CGID O=C(c1ccncc1F)N1CCc2c(Cl)cccc21 161456880 ZTBZZMSPHNTNKT-UHFFFAOYSA-N 276.698 3.077 70 20 CGID Cc1ccnc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160534024 FGRKPZDXVAJXHK-HUUCEWRRSA-N 269.348 3.117 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@H](C)C[C@H]1CCCO1 160669896 LWWKABRSQXZODX-DGCLKSJQSA-N 281.783 3.336 70 20 CGID CC(C)CCC(=O)NC[C@H](C[C@H](C)O)c1ccccc1 159814022 SSOKRJDISVIERM-HOCLYGCPSA-N 277.408 3.094 70 20 CGID CCOc1ccccc1NC(=O)N(C)[C@H]1CCSC1 159454539 DQIUWFVZAKTNLT-NSHDSACASA-N 280.393 3.055 70 20 CGID COc1ccc(N(C)C(=O)c2cc3ccccn3c2)cc1F 159580277 LNMIBOPPDWEZGJ-UHFFFAOYSA-N 298.317 3.364 70 20 CGID C[C@@H]1C[C@@H]1C(=O)Nc1cc(F)c(Br)cc1F 160741764 YCJQPBRYPTZJES-RITPCOANSA-N 290.107 3.322 70 20 CGID COc1ccc([C@@H](C)N(C)CC[C@@H]2CCCN2C)cc1 161354159 PMJDHARPNLZKLB-ZBFHGGJFSA-N 276.424 3.172 70 20 CGID C[C@@H](c1ccc(OC(F)F)cc1)N1CCC[C@@H](CN)C1 217527229 GLCPLRIIBRRZSK-RYUDHWBXSA-N 284.350 3.020 70 20 CGID CCCCn1ncc(C(=O)N[C@@H]2CCC[C@H](C)C2)c1C 161053686 LVGSNYCWXDRBBV-GXTWGEPZSA-N 277.412 3.300 70 20 CGID Cc1ccc(-c2cncc(C(=O)Nc3nncs3)c2)cc1 160297628 LRSMOJVWDUOCEA-UHFFFAOYSA-N 296.355 3.161 70 20 CGID CCCC1(CNC(=O)[C@@H]2CCOc3ccccc32)CC1 160734487 PMBTVQJAKOPNME-CQSZACIVSA-N 273.376 3.249 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1c1nc(-c2ccsc2)no1 160992770 WZMSIAXSNAFNGK-KCJUWKMLSA-N 262.334 3.271 70 20 CGID Cc1ccccc1[C@H](C)NCCCOCC1CCOCC1 159667555 MRALDQIZKUMVBF-INIZCTEOSA-N 291.435 3.479 70 20 CGID CCN(C)C(=O)c1cc2c(Br)cccc2[nH]1 159920499 QFBFKVQMLFBUAW-UHFFFAOYSA-N 281.153 3.022 70 20 CGID CCCn1nccc1CN[C@@H](C)c1ccc(F)c(F)c1 160015826 OBTZBODUCMAKHP-NSHDSACASA-N 279.334 3.422 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(F)ccc1F 159740300 WZSZROSSMMPPFQ-ZANVPECISA-N 253.292 3.273 70 20 CGID C1CCC(C2CCN(C[C@H]3CCCNC3)CC2)CC1 217122301 JYCCULCKRHHWDW-HNNXBMFYSA-N 264.457 3.278 70 20 CGID C[C@H](NC[C@@H]1CCc2ccccc21)C1CCN(C)CC1 161006357 NLCMNHKDHRLWLF-YOEHRIQHSA-N 272.436 3.036 70 20 CGID CCc1cccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1 161048406 WZLFAZOGOYLKGN-JKSUJKDBSA-N 288.391 3.328 70 20 CGID CCOCCC1(C(=O)NCc2ccc(C)c(F)c2)CCC1 161238224 FJMNRZXAIJLLBG-UHFFFAOYSA-N 293.382 3.347 70 20 CGID CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(C)nc2)C1 161332333 SVOMEQMIQTYCGW-WCQYABFASA-N 279.409 3.186 70 20 CGID CC[C@@H](NC(=O)C1=C(C)OCCC1)c1ccc(OC)cc1 161416881 DHHSXASMTVQMEZ-MRXNPFEDSA-N 289.375 3.347 70 20 CGID CSc1cc(C)ccc1CNC(=O)NC[C@@H](C)SC 160197033 OPCKRWJQCBVPJV-LLVKDONJSA-N 298.477 3.268 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)c1ccc(OC)c(F)c1 159669337 SFZZIUUVAJEFLF-NHYWBVRUSA-N 265.328 3.233 70 20 CGID COC(=O)c1ccc(CSC[C@H]2CCCCO2)s1 159676738 SMRCHKZJHTZWLC-SNVBAGLBSA-N 286.418 3.337 70 20 CGID COc1cc(CCC(=O)NCC(C)C)ccc1Cl 159495129 NMDLENALQVBTFS-UHFFFAOYSA-N 269.772 3.053 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@@H]2CCCOC2)C1 159523657 ZEFVKPLSXJYRNV-QWHCGFSZSA-N 291.416 3.188 70 20 CGID Clc1ccc([C@H]2CN(CCOCC3CC3)CCO2)cc1 159424396 ARBKLVZTFQXBFB-MRXNPFEDSA-N 295.810 3.140 70 20 CGID C[C@H](NCc1ccc(F)c(C(F)(F)F)c1)[C@H]1CCOC1 160153743 KWMKWXOBHNWMSB-ONGXEEELSA-N 291.288 3.359 70 20 CGID O=c1[nH]c2ccc(NCc3cc(F)cc(Cl)c3)cc2[nH]1 160810167 JKJBFBJOIKEWDN-UHFFFAOYSA-N 291.713 3.261 70 20 CGID CC1CCC(O)(CNCc2coc3ccccc23)CC1 161105224 APFASMQFBZICIA-UHFFFAOYSA-N 273.376 3.464 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)c1cc(F)c(F)c(F)c1 161466198 XAKTYKFTLUBRIP-YUMQZZPRSA-N 257.255 3.117 70 20 CGID Cc1cscc1CNC(=O)N1CCCCCC1 160697487 ZSYLAEJLVXVOQN-UHFFFAOYSA-N 252.383 3.142 70 20 CGID C[C@](O)(CNc1cncc(Cl)n1)c1ccccc1Cl 160196231 FXWUNAZJYNGRKJ-ZDUSSCGKSA-N 298.173 3.103 70 20 CGID CCN(CC)[C@@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160824948 NTNPATROZMAAAU-OAHLLOKOSA-N 280.456 3.146 70 20 CGID CCc1ccc(CNCc2nc3ccccc3n2C)s1 218107974 PKMGLVMZJOGRRH-UHFFFAOYSA-N 285.416 3.487 70 20 CGID C[C@@H](CC(=O)N1CCCC(C)(C)CC1)C1CCNCC1 161044897 ANTUQRPDVUGGFI-AWEZNQCLSA-N 280.456 3.051 70 20 CGID CC[C@@H](C)c1cc(C(=O)Nc2ccc(OC)c(N)c2)on1 161077357 PMNXZGKHCWHDLJ-SECBINFHSA-N 289.335 3.031 70 20 CGID CC(C)CCn1ccc(NC(=O)N2[C@@H](C)CC[C@@H]2C)n1 161195944 SWPGXKUIBXYJRE-STQMWFEESA-N 278.400 3.334 70 20 CGID Cc1ccc(F)c(OCC(=O)N2CCC[C@@H]3CCC[C@H]32)c1 161329288 KLLKQHFISHGRJH-DZGCQCFKSA-N 291.366 3.304 70 20 CGID CCCc1nc(Cn2nc(C3CC3)nc2C2CC2)cs1 161424672 HQHLZKSVNKIKPL-UHFFFAOYSA-N 288.420 3.490 70 20 CGID O=C(CCCOc1ccccc1)NCC1(C2CC2)CC1 160001570 CYZVTTSGWRRECV-UHFFFAOYSA-N 273.376 3.152 70 20 CGID CC[C@H](NCc1ccc(OC(C)C)nc1)C(C)C 160082554 INSPMDUPHPQQKD-AWEZNQCLSA-N 250.386 3.393 70 20 CGID CSc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)o1 160485240 XKBNZMGSOCZUBB-UHFFFAOYSA-N 291.328 3.007 70 20 CGID CC[C@@H](CC(=O)N(C)c1ccc2c(c1)OCO2)C(C)C 160504480 OGXFRYLJMPQEIL-LBPRGKRZSA-N 277.364 3.450 70 20 CGID CC[C@H](C)[C@@H](C)NC(=O)Nc1cc(C(=O)OC)cs1 160675864 RIPBOROMRASKEK-DTWKUNHWSA-N 284.381 3.091 70 20 CGID COC(=O)c1ccc(NC(=O)Nc2cscc2C)cc1 160682158 YCQSJZIGQOKYBS-UHFFFAOYSA-N 290.344 3.487 70 20 CGID CC(C)c1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cn1 160932197 WGJRQNZTKBNICU-BETUJISGSA-N 260.381 3.323 70 20 CGID CCCC1CCC(NC(=O)N(C)C[C@@H]2CCC[C@H]2O)CC1 159921563 ZPYHEHJKVIDROX-BHDPWAOGSA-N 296.455 3.148 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@H]1CCC[C@@H]2OCC[C@H]12 159772781 PEJQPCWNULNQJX-ILXRZTDVSA-N 293.794 3.336 70 20 CGID CN(Cc1c(F)cccc1Cl)C[C@H]1CCC[C@@H]1O 159463783 QRRIQLAPEQGMII-YGRLFVJLSA-N 271.763 3.072 70 20 CGID CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)c1ccnc(F)c1F)C2 218386901 CSVHTZAZPNBNQO-QEKSWQHZSA-N 294.345 3.304 70 20 CGID O=S(=O)(Cl)C[C@@H](F)c1ccc(C(F)(F)F)cc1 1537958584 DIQNKTIBHVEXND-MRVPVSSYSA-N 290.665 3.285 70 20 CGID CCCn1nc(C)c(C(=O)Nc2cccc(OC)c2)c1C 161139578 VOIWDIIVIOXSHM-UHFFFAOYSA-N 287.363 3.171 70 20 CGID O=C(CC[C@@H]1CCOC1)N1CCc2c(Cl)cccc21 161438622 LCEYMHILNNOTAV-LLVKDONJSA-N 279.767 3.046 70 20 CGID Cc1ccc(CCNC(=O)C[C@@H](C)c2c(C)n[nH]c2C)cc1 160210746 HURAWIVRHXFUAH-CYBMUJFWSA-N 299.418 3.187 70 20 CGID CC(C)OC(=O)CCCNC(=O)N(C)C1CCCCCC1 160217287 FIIXBLMHQLCANB-UHFFFAOYSA-N 298.427 3.082 70 20 CGID C[C@H](NCc1ccc(CN2CCOCC2)cc1)C(C)(C)C 160621388 UBYRFPPLHXPYBO-HNNXBMFYSA-N 290.451 3.043 70 20 CGID COc1ccc(O)c(NC(=O)C(C)(C)c2ccccc2)c1 160709271 GKIXYBBURVVWOP-UHFFFAOYSA-N 285.343 3.317 70 20 CGID Cc1cc(N[C@@H]2C=CCCC2)nc(-c2ccncc2)n1 160713003 XSHYRGXMYXXASB-CQSZACIVSA-N 266.348 3.368 70 20 CGID CCc1cc(O)nc(CN(C)[C@@H](C)c2ccc(C)cc2)n1 160871122 DXQJCKNUQMOVAX-ZDUSSCGKSA-N 285.391 3.246 70 20 CGID C[C@@H](CC(=O)N1[C@@H](C)CCC[C@H]1C)c1ccncc1 160956883 GUFNGXXQLLTZKL-MELADBBJSA-N 260.381 3.365 70 20 CGID CC[C@@H](C)OCC(=O)N(C)CCCOc1ccccc1C 159877609 KRFZQNCXLGCYBC-OAHLLOKOSA-N 293.407 3.037 70 20 CGID C[C@H](NCCO)c1ccc(-c2ccccc2F)s1 159680280 YJSLPHBEYSAEMK-JTQLQIEISA-N 265.353 3.197 70 20 CGID Cc1cc(NC(=O)c2ccc(C(C)C)cc2)c[nH]c1=O 159495305 CYRXPZJGVOJAFQ-UHFFFAOYSA-N 270.332 3.059 70 20 CGID CCOC(=O)[C@@H](N[C@H]1CCC(C)(C)C1)c1ccccc1 218749789 BVAUUQGYHPHTNH-GJZGRUSLSA-N 275.392 3.459 70 20 CGID CCNCC1CCN(C(=O)c2cccc(C)c2Cl)CC1 160401878 UWTHJPFSMUEXKN-UHFFFAOYSA-N 294.826 3.110 70 20 CGID CC1(C)C[C@H](NCc2coc3ccccc23)CCO1 160616501 BKWVWIVAEUTYKV-CYBMUJFWSA-N 259.349 3.480 70 20 CGID CCc1ncnc(N[C@H]2CCC[C@@H](SC)C2)c1F 218024124 OFOMQWCBJQQRGH-VHSXEESVSA-N 269.389 3.264 70 20 CGID CCC[C@H](C)CC(=O)Nc1ccc(OC)c(N)c1 161197684 MLEGCXYTYXTLKW-JTQLQIEISA-N 250.342 3.042 70 20 CGID CC1(NC(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)CCC1 161472105 GYCBICOVEPSUMF-QWHCGFSZSA-N 278.783 3.438 70 20 CGID COc1cccc2cc(CNCC3(CO)CCCC3)oc12 160089816 LYJPFJZWKWKDRL-UHFFFAOYSA-N 289.375 3.084 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc(-c2ccccc2)on1 160118276 PUOQWXOJEACDNS-UHFFFAOYSA-N 282.343 3.262 70 20 CGID CC[C@@H](SC)C(=O)N[C@@H]1CCCc2sccc21 160161040 LLDNWPSCDUQPQL-GHMZBOCLSA-N 269.435 3.383 70 20 CGID CC[C@H](NC(=O)c1cccs1)c1c(C)noc1C 160278311 CXHNTVLSQHQBAE-JTQLQIEISA-N 264.350 3.234 70 20 CGID CCCCN(C(=O)c1cnc2c(c1)ncn2C)[C@H](C)CC 160437560 HEQZCTSUCAQFBF-GFCCVEGCSA-N 288.395 3.009 70 20 CGID CC1CCN(C(=O)[C@@H](C)c2c(F)cccc2F)CC1 160565184 VYCGWIKKTHHHOO-NSHDSACASA-N 267.319 3.327 70 20 CGID CCCC1(CNC(=O)c2sc(C)cc2OC)CC1 160579343 SSPYXNMOCYEMSI-UHFFFAOYSA-N 267.394 3.375 70 20 CGID CC[C@H](NC(=O)c1sc(C)nc1C)c1c(C)noc1C 160674336 NAFRUPMWQWZYLR-NSHDSACASA-N 293.392 3.246 70 20 CGID CCCC1(CNC(=O)c2cc(OC)cs2)CC1 160809885 UKIGICSSKZOUBU-UHFFFAOYSA-N 253.367 3.067 70 20 CGID Cc1ccc(CNC(=O)Nc2ccc(N(C)C)cc2)cc1 217311401 BRRUMCUAYWMQDE-UHFFFAOYSA-N 283.375 3.383 70 20 CGID CCc1ncnc(N[C@H](C)c2ccc(F)cc2)c1F 217956290 IAMDQDUNRJGJGG-SECBINFHSA-N 263.291 3.490 70 20 CGID Cc1ccc([C@H](C)N[C@H]2CCN3CCCC[C@@H]23)cc1 217678985 RKQHXNIECJWZDH-XIRDDKMYSA-N 258.409 3.272 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2OC)cc1F 218197840 UGUMBIMBGCDTBJ-SGIREYDYSA-N 281.371 3.443 70 20 CGID Cc1cc(F)c(C(=O)Nc2ccc3[nH]ncc3c2)cc1F 161018064 ORAHZDWDAZEJJQ-UHFFFAOYSA-N 287.269 3.402 70 20 CGID Cc1cc(NC(=O)[C@H](C)Cc2ccccc2Cl)nn1C 161176622 GQURIARJQBQDIN-SNVBAGLBSA-N 291.782 3.199 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1scnc1C 161227967 SCGPXPFOEUJUJQ-VXGBXAGGSA-N 266.410 3.492 70 20 CGID Cc1sc2ncnc(SCc3ccnn3C)c2c1C 161229100 HQQNPHTYGFAQQO-UHFFFAOYSA-N 290.417 3.334 70 20 CGID Cc1ccc(CNC2CCN(c3ccccc3)CC2)cn1 161298145 ZKQISMKADNHIIL-UHFFFAOYSA-N 281.403 3.149 70 20 CGID O=C([C@@H]1CCCO1)N1C[C@@H]2CCCC[C@@]21c1ccccc1 161302310 SBVUBWVFAHJNAV-XYJFISCASA-N 285.387 3.093 70 20 CGID Cc1ccc(NC(=O)N[C@H](C)c2ncc(C)s2)cn1 161320230 IWFGLMMHVVDDSP-SNVBAGLBSA-N 276.365 3.038 70 20 CGID CC[C@@H](NCCn1ccnc1)c1cccc(Cl)c1F 161495920 UQHUZGACLDEPLE-CYBMUJFWSA-N 281.762 3.417 70 20 CGID CCc1ccc([C@@H](C)CC(=O)NCCN(C)C(C)C)cc1 160182650 VVBVTQRHNJYRAA-HNNXBMFYSA-N 290.451 3.199 70 20 CGID Cc1noc(Cl)c1CC(=O)N1C[C@@H](C)c2ccccc21 160289080 HEHALGMBUXZFMU-SECBINFHSA-N 290.750 3.329 70 20 CGID CNC(=O)c1ccc(NC(=O)CCC(C)C)c(Cl)c1 160311244 AJMNYWUEPZLTAJ-UHFFFAOYSA-N 282.771 3.074 70 20 CGID Cc1n[nH]c(C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F 160793484 OUFPVACKSICMCU-WDEREUQCSA-N 291.301 3.047 70 20 CGID O=C(Nc1cc(F)ccc1F)N[C@H]1CCO[C@H](C2CC2)C1 160990247 LLUQFRKRPVOGOI-FZMZJTMJSA-N 296.317 3.044 70 20 CGID CC[C@H](NC(=O)Nc1cc(F)ccc1C)[C@@H]1CCCO1 159405209 SOLMXLUYXPZGDC-JSGCOSHPSA-N 280.343 3.213 70 20 CGID CN(C)Cc1ccc(C(=O)N[C@H]2CCCc3occc32)cc1 159635828 DBHDNJFJEOOLJO-INIZCTEOSA-N 298.386 3.149 70 20 CGID Cc1ccc(OC(=O)[C@@H]2CCCCO2)c(Br)c1 159993055 BWHFAIIKHHVXQS-LBPRGKRZSA-N 299.164 3.232 70 20 CGID O=C(NC1CC1)c1cc(Cl)cc(C(F)(F)F)c1 159675071 YSVXHPQIDHZJGS-UHFFFAOYSA-N 263.646 3.251 70 20 CGID c1ccc([C@@H]2CCN(CCCN3CCCCC3)C2)cc1 161299949 SMXZMWIAQGVZNB-GOSISDBHSA-N 272.436 3.352 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cscn1 161098453 XZUQOTZWXZXLPD-JQWIXIFHSA-N 252.383 3.184 70 20 CGID Cc1occc1CN(C)C(=O)c1cnn(CC(C)C)c1C 161099409 HEZXVRXGIZADKA-UHFFFAOYSA-N 289.379 3.021 70 20 CGID CC(C)OC(=O)c1ccc(OCc2nccs2)cc1 161258858 OGSULDFKRDZGRE-UHFFFAOYSA-N 277.345 3.287 70 20 CGID C[C@H](CC(=O)N[C@H]1CCCC1(C)C)c1ccncc1 161295164 MBMLEZGVBFUWJU-OCCSQVGLSA-N 260.381 3.270 70 20 CGID Cc1cc(C)cc(C[C@H](C)NC(=O)CNc2ccccc2)c1 161347974 YMJPKQVPNDRFGL-INIZCTEOSA-N 296.414 3.463 70 20 CGID CCC[C@H](C)[C@H]1CCCN1Cc1nnc(C)n1CCC 161429214 QYGBAEWPPQIIHA-DZGCQCFKSA-N 278.444 3.397 70 20 CGID CC[C@@H](NC(=O)C(C1CC1)C1CC1)c1c(C)noc1C 160216520 YZLBTVQXERVIJG-CYBMUJFWSA-N 276.380 3.295 70 20 CGID CC(C)CC(=O)O[C@H](c1ccccn1)C(F)(F)F 160380791 KGBLDGQCIKWDFT-LLVKDONJSA-N 261.243 3.274 70 20 CGID CCCC1(CNC(=O)c2cnn(C(C)(C)C)c2C)CC1 160638368 BTPYIANRMJYHDR-UHFFFAOYSA-N 277.412 3.257 70 20 CGID CC1(C)C[C@H](Nc2cnc3cc(F)c(F)cc3n2)CCO1 160675237 HRDXEIJWDIONMN-SECBINFHSA-N 293.317 3.278 70 20 CGID CC[C@H](NCCC(=O)OC(C)C)c1ccc(F)cc1F 160693268 KZQORHVPJPKGTH-AWEZNQCLSA-N 285.334 3.347 70 20 CGID CS[C@H](C)CC(=O)N1CCC[C@H]1C1CCCC1 160709025 KVNFTQQEKFCGSY-YPMHNXCESA-N 255.427 3.309 70 20 CGID Clc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)s1 159540527 DCBCARBPKXHMRL-DRZSPHRISA-N 283.824 3.449 70 20 CGID CCC(=O)Nc1ccc(N[C@@H](C)CCn2cccn2)cc1 159376866 XRDZOPDXUZONOC-ZDUSSCGKSA-N 286.379 3.122 70 20 CGID CCC1(CNC(=O)NC2C[C@H](C)O[C@@H](C)C2)CCCC1 159997748 VFQMGFPANZOXSG-STQMWFEESA-N 282.428 3.212 70 20 CGID Fc1ccc(NCc2nnc3n2CCCC3)cc1Cl 217319586 HOIBVXAFDJQNAB-UHFFFAOYSA-N 280.734 3.019 70 20 CGID C/C=C/C=C/C(=O)N[C@H]1CCOC2(CCCCC2)C1 161464648 GLZZOXJKUGSJAB-UZUBSOBESA-N 263.381 3.117 70 20 CGID COc1cc([C@H](C)NC2CCN(C)CC2)ccc1SC 161501799 SBLIWZCXFWNJGJ-LBPRGKRZSA-N 294.464 3.162 70 20 CGID COc1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)c(C)c1 160224519 BTQHQEYNBDLBAK-UHFFFAOYSA-N 299.326 3.009 70 20 CGID CC(C)NCCC(=O)Nc1ccc(CC(F)(F)F)cc1 160301637 ZOURRZWRPRNBBR-UHFFFAOYSA-N 288.313 3.118 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ncnc2oc(C)c(C)c12 160547875 ZXOKNLJHXXAFDJ-MEBBXXQBSA-N 273.336 3.214 70 20 CGID Cc1cc(C(=O)NCCCF)c(C)cc1Br 160611194 RECCCUWOEQUABN-UHFFFAOYSA-N 288.160 3.155 70 20 CGID CC[C@H](NC(=O)C[C@@H]1CCCN1)C(C)(C)c1ccccc1 160762773 WBBFIBXCEMNCEU-HOTGVXAUSA-N 288.435 3.001 70 20 CGID CSc1cc(C(=O)N[C@@H](C)C[C@@H]2CCCO2)ccc1F 160837373 IUBRBOZNPWHXSB-JQWIXIFHSA-N 297.395 3.235 70 20 CGID Cc1nccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1Cl 159425312 PBXTVYYRBRJUDK-SNVBAGLBSA-N 297.786 3.123 70 20 CGID CCCCn1ncc(NC(=O)N2CC[C@H](C)[C@@H]2C)c1C 159937347 LTZBMMSSZFBBKX-RYUDHWBXSA-N 278.400 3.254 70 20 CGID Cc1ccc(CCNC(=O)NCc2ccc(C)cc2)cc1 217307801 RYPYZAVQKVCRNA-UHFFFAOYSA-N 282.387 3.345 70 20 CGID CCC[C@@H](C)CS(=O)(=O)N[C@@H]1CCCc2ccccc21 217181912 NOUSEBTXIZZNAT-CZUORRHYSA-N 295.448 3.420 70 20 CGID O=C([C@@H]1C[C@@H]1c1ccc(Br)cc1)N1CCCC1 217806706 HOVHKJPHKDFKPE-CHWSQXEVSA-N 294.192 3.175 70 20 CGID CC[C@@H](C)N(C)CCNCc1cc(Cl)ccc1OC 217397411 DZHABVVDBWHNBX-GFCCVEGCSA-N 284.831 3.169 70 20 CGID CC[C@H]1CCCN(C(C)(C)CN[C@@H](C)c2cnccn2)C1 161016835 MMEINDNUVSGJEY-GJZGRUSLSA-N 290.455 3.028 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)C2CCCC2)o1 161244419 RPTPGKPRJBHQCE-CQSZACIVSA-N 277.364 3.280 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@H]1CC=CCC1 160496884 FZWVOAABOMPOHU-LSDHHAIUSA-N 277.408 3.341 70 20 CGID CCC(C)(C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160605002 QOLHNMHUGGAZTN-ZDUSSCGKSA-N 267.413 3.421 70 20 CGID CC[C@@H](NC[C@@H]1CCOC1)c1ccc(F)cc1F 160819961 ALSMMTLMQIURQA-IINYFYTJSA-N 255.308 3.042 70 20 CGID CC(C)C[C@H](CO)NC(=O)C(C)(C)c1ccccc1Cl 160914078 DETLBDKCAICSPN-GFCCVEGCSA-N 297.826 3.141 70 20 CGID c1ccc2c(c1)OCCC[C@H]2N[C@@H]1CCCSC1 159608559 ZTPLCCXOAMJPNP-TZMCWYRMSA-N 263.406 3.386 70 20 CGID Cc1cc(C)cc(CCN[C@@H](C)C2CCOCC2)c1 159517582 NCXYIRMEVSQOLZ-HNNXBMFYSA-N 261.409 3.251 70 20 CGID CC[C@H](C)[C@H](C)NC(=O)CSc1nc2ccccc2[nH]1 159778070 UIXCSOJKAYVWRK-QWRGUYRKSA-N 291.420 3.206 70 20 CGID CCOC(=O)[C@H](CC)Sc1nc(C(C)(C)C)ns1 159799700 FHVDRRKEDRBZOH-QMMMGPOBSA-N 288.438 3.269 70 20 CGID CN1CCC(CCNCc2ccc(F)c(Cl)c2)CC1 160145935 OYONLCRTQCGVIP-UHFFFAOYSA-N 284.806 3.301 70 20 CGID OCC1(CNc2nc(Cl)nc3ccccc23)CCCC1 160252668 DFXLFYHBQNHFSR-UHFFFAOYSA-N 291.782 3.248 70 20 CGID CC1CCN(C(=O)N(C)CCc2ccccc2)CC1 160636867 VUAKYVKFWDKGEY-UHFFFAOYSA-N 260.381 3.013 70 20 CGID CCCc1noc(CCCC(=O)NCC2(CCC)CC2)n1 160473996 YZZMALCIWJRQMF-UHFFFAOYSA-N 293.411 3.041 70 20 CGID CC(C)CN1CC[C@@H](CNC(=O)C2CCC(C)(C)CC2)C1 161168353 ZIFDRQVQUZXBBZ-HNNXBMFYSA-N 294.483 3.297 70 20 CGID Cc1occc1C(=O)N[C@H](C)CC(=O)c1ccc(F)cc1 161217025 KROXXQJJNHOBJC-SNVBAGLBSA-N 289.306 3.118 70 20 CGID CN(C(=O)[C@@]1(C)CCCNC1)c1ccc2ccccc2c1 161301760 OQXPFBREABUUKV-SFHVURJKSA-N 282.387 3.192 70 20 CGID CC(C)(CN)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 161334508 KBQOXMMHTQJZGG-UHFFFAOYSA-N 294.370 3.071 70 20 CGID CC(C)n1cccc1C(=O)NCCCc1ccccc1 160381012 CGBLECVNGMZOAU-UHFFFAOYSA-N 270.376 3.432 70 20 CGID CCCCCNC(=O)[C@@H](C)c1c(F)cccc1F 160472807 AOTCLRVXFIAIGF-JTQLQIEISA-N 255.308 3.375 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@@H](Cc1ccccc1)C1CC1 160464183 RALDWDOTXLBUNP-SQNIBIBYSA-N 273.420 3.148 70 20 CGID CC1(C)C[C@H](NCc2cccc3c2OC(C)(C)C3)CCO1 160500656 CCBRFXVYAFUQIH-OAHLLOKOSA-N 289.419 3.447 70 20 CGID CS[C@H](C)CC(=O)N(C)c1cc(C)cc(C)c1 160580738 FDZBZGMGTHYCGW-GFCCVEGCSA-N 251.395 3.408 70 20 CGID C[C@@]1(CNC(=O)N[C@H]2CCCc3occc32)CCCS1 160672847 NQIHOBQOMLUPLD-WFASDCNBSA-N 294.420 3.242 70 20 CGID CC/C=C(/C)C(=O)N[C@H](C)CC(=O)c1cccs1 160706442 KZMYTQQIGCYBJI-SDKXAQGSSA-N 265.378 3.182 70 20 CGID CN(CCOCc1ccccc1)C(=O)C[C@H]1C=CCC1 159433847 CPNXYUJZENWGKQ-HNNXBMFYSA-N 273.376 3.018 70 20 CGID C[C@@H](OCC1CC1)C(=O)N[C@@H]1CCCc2sccc21 159839200 JUBNGAIVMKYORR-ZWNOBZJWSA-N 279.405 3.057 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCCOCC1CC1 159847792 PVKJPSIXCPUUFW-UONOGXRCSA-N 293.432 3.093 70 20 CGID Cc1ccc(CNC(=O)c2ccc(CN(C)C)cc2)c(C)c1 159856563 PRDRFDIQTDRWDC-UHFFFAOYSA-N 296.414 3.295 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1C(=O)N(C)Cc1cccnc1 159467457 KNTSDPNKVZJACE-UONOGXRCSA-N 286.400 3.214 70 20 CGID COc1ccc(N(C)C(=O)[C@@H](C)C2CC2)cc1Cl 159901069 BVLSXTAGJFQGQX-VIFPVBQESA-N 267.756 3.358 70 20 CGID CC(C)(C)c1nsc(Nc2cnn(CC(F)F)c2)n1 159531652 ACJSMUWPVSFFCR-UHFFFAOYSA-N 287.339 3.041 70 20 CGID CC[C@@H](NC(=O)Nc1ccnc(C)c1Cl)[C@@H]1CCCO1 159942809 SASOHPKFPNMZON-PWSUYJOCSA-N 297.786 3.123 70 20 CGID C[C@H]1[C@@H](C)SCCN1c1nc(C(C)(C)C)ns1 159550329 DLGCYTNTLMPQPM-DTWKUNHWSA-N 271.455 3.166 70 20 CGID CCC1(CNC(=O)NCC2(C3CC3)CC2)CCC1 159551939 PXTYLFXFACEISX-UHFFFAOYSA-N 250.386 3.056 70 20 CGID CC(C)[C@H](C)N(C)C[C@@H](O)c1cc2ccccc2o1 216933244 FSBVGTICQUBAQH-GXTWGEPZSA-N 261.365 3.443 70 20 CGID Cc1cccc(CN[C@@H]2CCN3CCCC[C@@H]23)c1C 218044596 IOAPMOAVHXIKIV-SJORKVTESA-N 258.409 3.020 70 20 CGID CCN1CCCC[C@H]1CN[C@@H]1CCCc2nc(C)sc21 161197318 IKQZXNBDXKDNEE-UONOGXRCSA-N 293.480 3.293 70 20 CGID CS[C@H](C)CNC(=O)[C@@H](OC(C)(C)C)c1ccccc1 161311401 TYLGBMJJSAYHDT-OCCSQVGLSA-N 295.448 3.411 70 20 CGID COc1cc(F)c(C(=O)NC2CCC(C)CC2)cc1OC 161337742 GBUKNFCXHHKGKY-UHFFFAOYSA-N 295.354 3.151 70 20 CGID CCSCc1cccc(NC(=O)[C@H]2CCCCN2)c1 160421857 IMHJLALADKDRSP-CQSZACIVSA-N 278.421 3.020 70 20 CGID Cc1n[nH]c(C)c1NC(=O)[C@H]1C[C@H]1c1cccc(F)c1F 160793612 OUFPVACKSICMCU-QWRGUYRKSA-N 291.301 3.047 70 20 CGID CC[C@H](NCCCCC(=O)OC)c1ccc(F)cc1 160832674 TURNVEOILSBVNE-AWEZNQCLSA-N 267.344 3.210 70 20 CGID CCc1cccc(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)c1 160916117 PEFWNBWGWXMQIN-HNNXBMFYSA-N 292.423 3.414 70 20 CGID C[C@H](CCn1cccn1)Nc1ccc2c(c1)OC(C)(C)O2 159413331 VKMFHDUXOZDCBV-GFCCVEGCSA-N 287.363 3.281 70 20 CGID CC(C)(C)c1ccccc1NC(=O)N[C@@]1(C)CCOC1 159427126 LHSNWTNFVFXABB-INIZCTEOSA-N 276.380 3.285 70 20 CGID O=C(CSc1ccc(F)cc1)NCC1(C2CC2)CC1 159839525 HFZIRNLDORFIPD-UHFFFAOYSA-N 279.380 3.224 70 20 CGID CS[C@@H](C)CC(=O)Nc1cccc(OC(F)F)c1 159478282 ZIIJYIUDILSLQL-QMMMGPOBSA-N 275.320 3.368 70 20 CGID CSC[C@@H](C)C(=O)O[C@H](c1ccccn1)C(F)(F)F 159911501 OEFSVCGFWPKHEV-PSASIEDQSA-N 293.310 3.227 70 20 CGID CC(C)COC[C@@H](O)CNC(C)(C)c1ccc(Cl)cc1 159590983 VORMEBQPLPVUDS-HNNXBMFYSA-N 299.842 3.198 70 20 CGID C[C@@H]1CCC[C@@H](N(C)C(=O)C[C@@H](N)c2ccccc2)C1 218597199 BPQYLHOUZKREBP-FVQBIDKESA-N 274.408 3.114 70 20 CGID CCN(CC)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 217795135 NYHWHDCODVERDM-QWHCGFSZSA-N 296.208 3.421 70 20 CGID C[C@@H](NCCSc1ccc(Cl)cc1)[C@@H]1CCOC1 160052600 DACSURIMADVIPA-VXGBXAGGSA-N 285.840 3.447 70 20 CGID COc1ccc(N(C)C(=O)C(C)(C)C)cc1Cl 160103184 DQSJGJVKTFGJPG-UHFFFAOYSA-N 255.745 3.358 70 20 CGID COc1ccc(N(C)C(=O)[C@@H](C)SC)cc1Cl 160167246 FNESGHJKMJCOOK-MRVPVSSYSA-N 273.785 3.063 70 20 CGID Cc1ccc(-c2cncc(C(=O)Nc3ccn(C)n3)c2)cc1 160177614 VJLSEKFKIAHBQX-UHFFFAOYSA-N 292.342 3.043 70 20 CGID O=C(CCC1CC1)O[C@H](c1ccccn1)C(F)(F)F 160269051 UMNIVXYSZLLPNR-GFCCVEGCSA-N 273.254 3.418 70 20 CGID Cc1ccccc1-c1cccc(CN2CCC[C@@H]2C(N)=O)c1 160340996 IMMZDYXMSYKPQD-GOSISDBHSA-N 294.398 3.112 70 20 CGID COc1cccc(C[C@@H](NCC(C)(C)O)c2ccccc2)c1 160603743 LOWQUFCRNMVZBU-GOSISDBHSA-N 299.414 3.340 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)C[C@@H](C)C1CCCCC1 160677503 ZGUHUCZJTVLPIH-OLZOCXBDSA-N 283.412 3.051 70 20 CGID Cc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)s1 159623287 GQVJJKYAFWSDKV-IHRRRGAJSA-N 263.406 3.104 70 20 CGID O=C(NCCCOC1CCCCC1)N1CCC2(CCC2)C1 159392686 DRLTXFPLUCIXOB-UHFFFAOYSA-N 294.439 3.311 70 20 CGID CCCCCNC(=O)NCc1ccccc1Cl 217314118 VXXMIVFAAQQMFT-UHFFFAOYSA-N 254.761 3.329 70 20 CGID CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)[C@@H](C)CNC 161247430 FHXLJQVYNDMKQC-DOTOQJQBSA-N 290.451 3.020 70 20 CGID CC[C@H](CNC(=O)C(CC)(CC)CN)c1ccccc1 161168279 VOPXHIAFOQPJTP-CQSZACIVSA-N 276.424 3.062 70 20 CGID Cc1ccc(-c2nnc(SCc3ccnn3C)o2)cc1 161261686 HAZCGDGHVHYPOR-UHFFFAOYSA-N 286.360 3.071 70 20 CGID CCC1CCC(CNC(=O)C[C@H](C)SC)CC1 160674445 UVYOFWPGVSTJBF-HIFPTAJRSA-N 257.443 3.461 70 20 CGID CC[C@@H](C)[C@H](C)NC(=O)Nc1cc(C(=O)OC)cs1 160676002 RIPBOROMRASKEK-BDAKNGLRSA-N 284.381 3.091 70 20 CGID CC(C)(C)c1nc(CCNC(=O)C[C@@H]2C=CCC2)cs1 160699428 HMGOPVOORBIWAB-GFCCVEGCSA-N 292.448 3.456 70 20 CGID CC(C)c1cc(=O)n(Cc2ccc(C(F)(F)F)cc2)cn1 160761778 ZUWRFDLLUXMPSP-UHFFFAOYSA-N 296.292 3.434 70 20 CGID Cc1cc(C)n(-c2ccc(C(=O)NC3CC=CC3)cc2F)n1 160845019 WQJBXSFBZWLQBB-UHFFFAOYSA-N 299.349 3.077 70 20 CGID c1cnc2ccc(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)cc2c1 159478283 YAPOJXIEQDOQEW-NXHRZFHOSA-N 294.398 3.282 70 20 CGID c1cn(CCN2CCC[C@H]2CC2CCCCC2)cn1 159784693 WJLZRXSJMPTMGB-INIZCTEOSA-N 261.413 3.318 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2ccc(N)cc2Cl)O1 160777240 BWXRWONZVKJEEN-JTQLQIEISA-N 283.755 3.037 70 20 CGID O=C([C@@H]1CCCO1)N1C[C@H]2CCCC[C@]21c1ccccc1 161301972 SBVUBWVFAHJNAV-RYRKJORJSA-N 285.387 3.093 70 20 CGID COc1cc(Cl)ccc1C(=O)N1[C@H](C)CC[C@H]1C 161390092 UTUXEWRMDJKATN-NXEZZACHSA-N 267.756 3.362 70 20 CGID CCSc1ccccc1[C@@H](C)NCC(C)(C)O 160610192 YABIAYASEDYSRJ-LLVKDONJSA-N 253.411 3.220 70 20 CGID CC(C)c1nsc(N[C@@H]2CCOC(C)(C)C2)n1 160687081 PVZZYPHAJAOLFO-SECBINFHSA-N 255.387 3.031 70 20 CGID CS[C@H](C)CC(=O)NCc1ccccc1OCC(C)C 160769308 LLJJTLPMZXZHSG-CYBMUJFWSA-N 295.448 3.479 70 20 CGID Cc1n[nH]c(C)c1NC(=O)CCc1c[nH]c2c(C)cccc12 160795083 OKDHYLWJSFJMRJ-UHFFFAOYSA-N 296.374 3.388 70 20 CGID Cn1cnnc1CN1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 160808218 DPDSYGLZPOUGKA-MRXNPFEDSA-N 298.434 3.450 70 20 CGID CCC(CC)CNC(=O)Nc1cc(C(=O)OC)cs1 160818690 BBTHJAQMADYLDD-UHFFFAOYSA-N 284.381 3.092 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(F)cc2F)cc1F 159602205 QBUFICJUOGBSNJ-UHFFFAOYSA-N 295.260 3.389 70 20 CGID COC(=O)c1ccsc1NC(=O)C[C@H]1CC[C@H](C)C1 159382631 LBDBFXCIOQOZSV-UWVGGRQHSA-N 281.377 3.300 70 20 CGID CC[C@H](C)[C@H](C)NC[C@@H](O)COc1ccccc1Cl 218775448 OHMRFHGWGATGCT-RWMBFGLXSA-N 285.815 3.104 70 20 CGID COc1ccc(NC(=O)[C@H]2CCC[C@H](C)C2)cc1N 161255527 HPYKDDFBCOYBPP-QWRGUYRKSA-N 262.353 3.042 70 20 CGID CN(C)[C@@H]1CCC[C@@H](N[C@@H]2CCc3ccccc32)C1 161034777 BOXOVJHDLKZTBA-BFYDXBDKSA-N 258.409 3.136 70 20 CGID C[C@@H](CCC(=O)NCc1ccc[nH]1)c1ccccc1 161234822 LQNJMTXGZGPZQW-ZDUSSCGKSA-N 256.349 3.215 70 20 CGID COc1ccc(NC(=O)CCO[C@H](C)CC(C)C)cc1N 161353222 AGFAWCZTKSXXFN-GFCCVEGCSA-N 294.395 3.057 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@H]1CCCC[C@@H]1C 160006570 JYTZIBQJUIKVRS-XJKSGUPXSA-N 289.423 3.058 70 20 CGID Cc1cccc([C@@H](NC(=O)C(F)(F)F)c2ccccn2)c1 160017621 WQZJQXZUCSCEJT-CYBMUJFWSA-N 294.276 3.158 70 20 CGID CCc1cc(NC(=O)[C@H](CC)c2ccc(F)cc2)n(C)n1 160074638 HRZUHPZPNKKOQA-CQSZACIVSA-N 289.354 3.254 70 20 CGID CSc1cc(C(=O)Nc2ccncc2)ccc1F 160436635 KAICRKIBBSXUHO-UHFFFAOYSA-N 262.309 3.195 70 20 CGID Cc1[nH]c2ccccc2c1CCNC(=O)NC1(C)CCC1 160565835 ULWOJEDAGRSJCV-UHFFFAOYSA-N 285.391 3.261 70 20 CGID CC(C)[C@H](CCO)NC(=O)CCc1ccc2ccccc2c1 160720575 KTUZAVCZBTWVBO-SFHVURJKSA-N 299.414 3.296 70 20 CGID C[C@@H](CCSc1ccccc1)N(C)C[C@H](O)C1CC1 160808115 HQTOBUBYWSMVDZ-BBRMVZONSA-N 279.449 3.260 70 20 CGID COC[C@H]1CCCN1C(=O)C[C@@H]1CCCCC1(C)C 160883453 YLYGIJJFWYQAOZ-UONOGXRCSA-N 267.413 3.230 70 20 CGID CCCNC(=O)c1ccccc1NCc1ccco1 160943565 JRVNBOCPRYKISG-UHFFFAOYSA-N 258.321 3.032 70 20 CGID O=S(=O)(c1ccccc1Cl)N1CC[C@@H]2CCCC[C@@H]21 159805832 SZBGWGAMXJTADO-AAEUAGOBSA-N 299.823 3.293 70 20 CGID CCC1(CNC(=O)NCCc2c(C)noc2C)CCCC1 159582813 SOFOQEAXARZFIK-UHFFFAOYSA-N 293.411 3.104 70 20 CGID COc1cc(NCc2cnn(C(C)(C)C)c2)ccc1F 159996072 CDNGCDHOGWOQOG-UHFFFAOYSA-N 277.343 3.398 70 20 CGID CC(C)(C)NC(=O)Cc1ccccc1C(F)(F)F 218574157 DSWLDAYGKXJWBF-UHFFFAOYSA-N 259.271 3.163 70 20 CGID C[C@@H]1CCCC[C@@H]1NC(=O)NCCCOc1ccccc1 217299731 VITMWBWYWCWVNH-ZBFHGGJFSA-N 290.407 3.333 70 20 CGID O=C(Nc1ccccn1)N[C@H]1CCCc2sccc21 161168604 GPROPSZDDBJNOF-NSHDSACASA-N 273.361 3.342 70 20 CGID C[C@@H](Cc1ccccc1Cl)C(=O)NC1(C)CCOCC1 161403183 UJVOSPBTGZCDMC-LBPRGKRZSA-N 295.810 3.204 70 20 CGID C[C@H]1CCCC[C@@H]1NC(=O)COc1ccc2[nH]ccc2c1 160019049 IPORJJHCZCHQHU-WFASDCNBSA-N 286.375 3.242 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(C2CC2)nc(C)n1 160275063 PFKKXVWAJHWUJH-ABAIWWIYSA-N 259.353 3.037 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1ccc(C)cc1 160622423 KCYVTXTUVUAMOV-UHFFFAOYSA-N 285.391 3.483 70 20 CGID C[C@H]1CCC[C@@H](CC(=O)N(C)Cc2cccn2C)C1 160713229 CVJNDZQYGXGAAO-UONOGXRCSA-N 262.397 3.200 70 20 CGID COCCCNC(=O)Cc1cc2c(ccc3ccccc32)o1 159888600 TVENDDJQWRKFBT-UHFFFAOYSA-N 297.354 3.281 70 20 CGID C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@@H]1CCCSC1 159533815 GMLRIVQQKPLOHX-BXUZGUMPSA-N 296.411 3.028 70 20 CGID CC(C)CO[C@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159959503 IRDRFTUCJSJQDJ-NSHDSACASA-N 283.441 3.087 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H]2CCN(C)[C@H](C)C2)C1 159377716 ZERAIUAXYKNGKX-TUVASFSCSA-N 270.486 3.123 70 20 CGID C[C@@H](NC(=O)N(C)CC1CCOCC1)C1CCCCC1 159378567 JTQNITGRMZFQCK-CYBMUJFWSA-N 282.428 3.023 70 20 CGID CCOC(CCN[C@H](C)c1cccc(C)c1)OCC 160215474 FDROERNPOPMYPM-CQSZACIVSA-N 265.397 3.435 70 20 CGID CC(C)(C)[C@H]1CCN(C(=O)c2ccc3[nH]cnc3c2)C1 161444523 JDZYOOHFAVBXHR-LBPRGKRZSA-N 271.364 3.071 70 20 CGID COc1c(C(C)=O)ccc(Br)c1Cl 218162349 AIWKVJFUWOTFAI-UHFFFAOYSA-N 263.518 3.314 70 20 CGID CCOCCC1(CNC(=O)N2CCC[C@H]2CC(C)C)CC1 161491783 CXOTVYDMPWFZJJ-HNNXBMFYSA-N 296.455 3.413 70 20 CGID CC[C@@H](C)[C@@H](C)NCc1ccc(CN2CCOCC2)cc1 160572508 XROTXJYZPHPOHX-HZPDHXFCSA-N 290.451 3.043 70 20 CGID CCCCOc1cccc(CN[C@H]2CCN(C)C[C@@H]2C)c1 160823808 KJCHJVVSQNHVKW-YJBOKZPZSA-N 290.451 3.295 70 20 CGID CC[C@@H](NCC1(C)COC1)c1ccc(F)cc1F 160915280 SCYHUHBFXFFNNT-CYBMUJFWSA-N 255.308 3.042 70 20 CGID C[C@@H]1CC[C@H](CCC(=O)N2CCc3c(F)cccc3C2)O1 160977058 QURJGRFMHMBNME-TZMCWYRMSA-N 291.366 3.058 70 20 CGID Cc1c(F)cccc1NC(=O)C[C@H]1CSCCS1 159616850 XUAANXLVHOMBTN-JTQLQIEISA-N 285.409 3.311 70 20 CGID Cc1cccc([C@@H](C)C(=O)NCCN2CCCCCC2)c1 159654219 MTKUHOBFJLOSKS-MRXNPFEDSA-N 288.435 3.091 70 20 CGID C[C@H](C(=O)Nc1cc(F)ccc1OC(F)F)C1CC1 159460655 SHLIMGRGZAMUHH-ZETCQYMHSA-N 273.254 3.412 70 20 CGID CC[C@@H](C)c1cc(C(=O)NCC2(C3CC3)CC2)on1 159720599 GHQSEIXEPPTLCI-SNVBAGLBSA-N 262.353 3.108 70 20 CGID CCCCn1ncc(NC(=O)NC(C)(C)CC)c1C 159936447 IIJOHXAJFCPUOZ-UHFFFAOYSA-N 266.389 3.302 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)N1CCC[C@@H]1c1ccccc1 159541594 PWFMAUAAMDKFHD-RRQGHBQHSA-N 285.387 3.355 70 20 CGID CCCN(CCCOCC)[C@H](C)C(=O)Nc1ccccc1 159954745 AOTODQCXEQGFTI-OAHLLOKOSA-N 292.423 3.152 70 20 CGID Cc1cnccc1NC(=O)[C@H](C)Cc1ccccc1F 159390202 IWZPUMCTWVLJQG-LLVKDONJSA-N 272.323 3.346 70 20 CGID CC[C@H](C)CN(C)CC(=O)N(C)[C@@H]1CCCC[C@@H]1C 217140100 LVPUREOYZCHPOE-SOUVJXGZSA-N 268.445 3.001 70 20 CGID CC[C@H](COC)NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1 217237742 MIGZTDIWULIQKR-HZSPNIEDSA-N 269.429 3.380 70 20 CGID Cc1ccc(CN[C@H](C)c2ccc(F)cc2N(C)C)cn1 161311310 JSPHGWYBHRTTRS-CYBMUJFWSA-N 287.382 3.446 70 20 CGID CC[C@@H](SC)C(=O)N[C@H](CC)c1c(C)noc1C 160575876 PJPBQVMQBKRPRJ-GHMZBOCLSA-N 270.398 3.000 70 20 CGID Cc1noc(C)c1[C@@H](C)NC(=O)C[C@H](C)c1ccncc1 160595556 VGJCGJJQOWKIBK-WDEREUQCSA-N 287.363 3.057 70 20 CGID COC(=O)c1ccccc1NC(=O)C1CCC(F)(F)CC1 160997494 OGYMBLMHJNKADR-UHFFFAOYSA-N 297.301 3.237 70 20 CGID C[C@H](C(=O)Nc1cccc([S@](C)=O)c1)c1ccsc1 159740433 QASIKKXOBLFVLL-APBUJDDRSA-N 293.413 3.228 70 20 CGID COc1cc(OC)nc(N[C@H](C)c2cc(C)sc2C)n1 159778622 QAJYBRGDCOJTGU-SECBINFHSA-N 293.392 3.345 70 20 CGID CCNc1cc(Br)cc(C(=O)OC)c1Cl 159498197 NUUKATVLZZKAIL-UHFFFAOYSA-N 292.560 3.321 70 20 CGID CSc1ccc(CN(C)CC2=CCCOC2)cc1 160914664 WDHRYCIVZFAXKI-UHFFFAOYSA-N 263.406 3.187 70 20 CGID COc1ccc(N(C)C(=O)[C@H]2C[C@@H]2C2CC2)cc1Cl 160311525 BYPWOMIZQJBPMD-NEPJUHHUSA-N 279.767 3.358 70 20 CGID COCCC(C)(C)CNc1nc(C(C)(C)C)ns1 160346173 HNUDYWSVJMVHKH-UHFFFAOYSA-N 271.430 3.310 70 20 CGID CN(C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1)C1CC1 160508851 XXECSZJAVFUUHD-ZBFHGGJFSA-N 272.392 3.202 70 20 CGID C1CCN(CCCN2CCC(OC3CCCC3)CC2)CC1 160769604 UVZSDTUFTFVXSB-UHFFFAOYSA-N 294.483 3.286 70 20 CGID COCCCOc1ccccc1NC(=O)C[C@H](C)SC 160854868 LQKQNOCLPHGTFW-LBPRGKRZSA-N 297.420 3.182 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](C)C2CCN(C)CC2)C1 159452304 OOBAOURJDGCMLB-CWRNSKLLSA-N 284.513 3.371 70 20 CGID CCCC[C@H](N[C@H](C)c1cccc(F)c1F)C(=O)OC 159489473 FULVVYGJBCOYSX-MFKMUULPSA-N 285.334 3.347 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)N(C)Cc1ccco1 159514888 DOVXWZPJSXJDTP-CHWSQXEVSA-N 275.373 3.412 70 20 CGID Cc1ccc([C@@H]2CCCCN2C(=O)CCNC(C)C)cc1 159912771 FPAYNZXLWCHXIE-KRWDZBQOSA-N 288.435 3.437 70 20 CGID COc1ccc(N(C)C(=O)c2ccoc2C)cc1F 159553047 LGBSTSIVCAJZDC-UHFFFAOYSA-N 263.268 3.012 70 20 CGID C[C@@H](CC(=O)N1CCC[C@@H]1C1CCC1)c1ccncc1 159950389 RDZKMEBGPYSYOG-XJKSGUPXSA-N 272.392 3.366 70 20 CGID COc1ccc2c(c1)C[C@@H](N[C@H]1CCOC(C)(C)C1)CC2 159976328 PVZBAYRNGIKKMV-HOTGVXAUSA-N 289.419 3.100 70 20 CGID CCOCCCN(Cc1ccccc1)C[C@H]1CCCO1 159550507 GOKBEABJTDMSIE-QGZVFWFLSA-N 277.408 3.094 70 20 CGID CCCC[C@@H](CC)COCCCS(=O)(=O)Cl 112395387 GHSVZFNWMYJNKO-LLVKDONJSA-N 270.822 3.178 70 20 CGID C1CNC[C@H](c2noc(C3C4CC5CC(C4)CC3C5)n2)C1 160249027 FSIVXTNLLYWGTL-ZPRMVTFISA-N 287.407 3.076 70 20 CGID Cc1nn(-c2ccccc2)cc1CN[C@@H]1CCOC(C)(C)C1 160536974 AVHDUEOMYLXGBA-MRXNPFEDSA-N 299.418 3.228 70 20 CGID CC[C@@H](C)[C@H](C)NCc1ccc(CN2CCOCC2)cc1 160572764 XROTXJYZPHPOHX-CVEARBPZSA-N 290.451 3.043 70 20 CGID CCC(CC)CNC(=O)N(Cc1cccnc1)C1CC1 160578188 BBIRYNFOJCSZFC-UHFFFAOYSA-N 275.396 3.192 70 20 CGID COc1cccc(Cl)c1CC(=O)N1C[C@@H]2CCC[C@H]2C1 160626662 HSCVWMWNPDYOQM-RYUDHWBXSA-N 293.794 3.150 70 20 CGID CN(Cc1ccco1)C(=O)NCC1(Cc2ccccc2)CC1 160807206 BVIYRFRURUPPCZ-UHFFFAOYSA-N 298.386 3.444 70 20 CGID Cc1cccc(CS(=O)(=O)Nc2c(C)cccc2F)c1 160829606 XVWLTUIVRVJADQ-UHFFFAOYSA-N 293.363 3.384 70 20 CGID CCOc1ccccc1NC(=O)N[C@H]1CCOC(C)(C)C1 160910098 AOVMJLOFYYNRHA-LBPRGKRZSA-N 292.379 3.164 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccccc1F 159405272 MBJKYGDUAMSUTM-LBPRGKRZSA-N 277.339 3.047 70 20 CGID CC[C@@H](C)CN(CC)C(=O)c1ccc(F)c(OC)c1 159663558 NYPQMBXGAMSLBC-LLVKDONJSA-N 267.344 3.343 70 20 CGID CC1CCN(CCNCc2ccc(Cl)cc2F)CC1 160792099 CMZSCISIGUGCAZ-UHFFFAOYSA-N 284.806 3.301 70 20 CGID CC(C)(C)OC(=O)NCCNCc1cc2ccccc2o1 218128487 CMWCFBNWCJAVGC-UHFFFAOYSA-N 290.363 3.047 70 20 CGID COc1ccc(O)c(C(=O)NCCC2=CCCCC2)c1 218114657 DCQYOUBSQMFHMY-UHFFFAOYSA-N 275.348 3.021 70 20 CGID CC[C@H](NCCn1ccnc1)c1cccc(Cl)c1F 161495805 UQHUZGACLDEPLE-ZDUSSCGKSA-N 281.762 3.417 70 20 CGID CCOCCN(CC)C(=O)C1CCC(C)(C)CC1 160125994 JONUPEDCPLOJJQ-UHFFFAOYSA-N 255.402 3.088 70 20 CGID CC[C@@H](CSC)N(C)c1nc(C(C)(C)C)ns1 160267702 QGGNQFMHTRVHFJ-VIFPVBQESA-N 273.471 3.413 70 20 CGID CCC[C@H]1[C@@H](C)CCCN1C(=O)NCCc1cscn1 159478937 YSPVAXDOIKSKFE-JSGCOSHPSA-N 295.452 3.296 70 20 CGID C[C@H]1CC[C@@H](C(=O)N[C@@H](C)[C@@H](C)C2CCCCC2)O1 159679692 MWCZBOSLDOYNIV-XFMPKHEZSA-N 267.413 3.275 70 20 CGID CCCc1nc(CSCc2c(CC)noc2C)no1 159747276 BJFAEHGQZRGXRW-UHFFFAOYSA-N 281.381 3.314 70 20 CGID CCCCOCCCNc1nc2ccc(N)cc2s1 160169372 MMBRYWWDCLQIJS-UHFFFAOYSA-N 279.409 3.497 70 20 CGID COc1ccc(NC(=O)[C@@H]2C[C@@H]2C2CCCCC2)cc1N 161030045 MPGDBPUBBORLGY-ZIAGYGMSSA-N 288.391 3.432 70 20 CGID CCN1CCCC[C@H]1CN[C@@H]1CCc2ccc(OC)cc21 161172178 WXMHBYPVRRBNJZ-MAUKXSAKSA-N 288.435 3.147 70 20 CGID CC(C)C[C@H](CO)NC(=O)[C@H](C)Cc1ccccc1Cl 161117951 QHGMHSMHCFKTGR-TZMCWYRMSA-N 297.826 3.042 70 20 CGID CC(C)CC(CC(C)C)NC(=O)[C@H]1CCn2ccnc2C1 161410315 VYNAEPMSIXOVGX-AWEZNQCLSA-N 291.439 3.023 70 20 CGID CCCC[C@@H](CC)CC(=O)N(C)C1C[C@@H]2CC[C@H](C1)N2 161502475 WKRBIOYJFNVERJ-JZWPEALZSA-N 280.456 3.334 70 20 CGID FC(F)(F)c1nnc(NC[C@H]2C[C@H]3CC[C@H]2C3)s1 160169632 NRIGOQZMMNAQIY-BIIVOSGPSA-N 277.315 3.405 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCCc1cc(C)ccc1OC 160169836 IFEKKSGKAFMJPF-RHSMWYFYSA-N 275.392 3.099 70 20 CGID C[C@@H](CC(=O)N1Cc2ccccc2C1)c1ccncc1 160459861 PXPQYCPXDABPBV-ZDUSSCGKSA-N 266.344 3.118 70 20 CGID Cc1ccc2ncc(CN(C)Cc3cccc(F)c3)n2c1 160473870 HHSQEFXIHCIUIV-UHFFFAOYSA-N 283.350 3.414 70 20 CGID O=C(Oc1cccc(F)c1)c1csc([C@@H]2CCCO2)n1 160497251 DHLVYMNBGJNSEJ-LBPRGKRZSA-N 293.319 3.353 70 20 CGID CCN1CC[C@@H](NCCSc2ccccc2)[C@H](C)C1 160514361 POOMDRSTNZMWJF-GDBMZVCRSA-N 278.465 3.099 70 20 CGID Cc1cc(N[C@@H](C)CCn2cccn2)ccc1N(C)C 159416763 MOOCSPIEJLILGC-AWEZNQCLSA-N 272.396 3.148 70 20 CGID O=C(CC/C=C/c1ccccc1)N[C@@H]1CCN(CC2CC2)C1 159487462 FCUXPFYVHLLQLR-SBLNNXNXSA-N 298.430 3.081 70 20 CGID CCCCO[C@H](C)C(=O)N(C)c1ccc(OC)c(F)c1 159505363 UGCBLGGHDIFNRL-LLVKDONJSA-N 283.343 3.002 70 20 CGID Cc1cccc(C)c1CNC[C@H](c1ccco1)N(C)C 160411678 MEFLXBBDWDEDBZ-MRXNPFEDSA-N 272.392 3.289 70 20 CGID CC[C@@H](C(=O)N[C@H]1CCOC(C)(C)C1)c1ccc(F)cc1 161375256 CQTNVBGHSFOCIO-LSDHHAIUSA-N 293.382 3.393 70 20 CGID Cc1cccc([C@@H](C)NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c1C 160096792 UCMQGLQLPJPZSC-JGGQBBKZSA-N 287.403 3.486 70 20 CGID CSC[C@H](CCO)N[C@H](C)c1cc(C)c(C)cc1C 160405989 OXUFSHUUFPSHBI-CABCVRRESA-N 281.465 3.376 70 20 CGID Cc1ccc2c(c1)N(C(=O)C[C@H](C)c1ccncc1)CC2 160278822 SUMHUYDJUOPDQC-AWEZNQCLSA-N 280.371 3.473 70 20 CGID C[C@@H]1C[C@H]1c1cc(NC(=O)CC2CCSCC2)[nH]n1 160317704 HLQKVCJCKMSZRA-MWLCHTKSSA-N 279.409 3.005 70 20 CGID CCCN(Cc1ccccc1)Cc1ccc(C(=O)N(C)C)[nH]1 160476011 BOUKTOXQYDYCCZ-UHFFFAOYSA-N 299.418 3.129 70 20 CGID Cc1cc(C)c(Br)c(C(=O)NCC(F)F)c1 160636050 IYQLHENUPXJOCK-UHFFFAOYSA-N 292.123 3.061 70 20 CGID CC[C@@H]1CCCN(C(=O)[C@@H]2CCC(=O)C[C@@H]2C)CC1 160798472 SLZLAIJIZIYBPJ-GZBFAFLISA-N 265.397 3.030 70 20 CGID O=C(Nc1c(F)cccc1F)N[C@@H]1CCO[C@H](C2CC2)C1 160999752 ZEOHALRRNQWXSC-MFKMUULPSA-N 296.317 3.044 70 20 CGID Cc1noc(C)c1[C@H](C)CNC(=O)N[C@H]1CCCC1(C)C 159462527 YQRBUZWOZKXMJL-MFKMUULPSA-N 293.411 3.273 70 20 CGID CC[C@@H](C)N(C)CCNCc1cc2cccc(OC)c2o1 217401125 IPOKATJWTPSKAN-CYBMUJFWSA-N 290.407 3.261 70 20 CGID COc1ccccc1CCNCc1cc(C)ccc1OC 218597533 VMTDCBNXXVTDEH-UHFFFAOYSA-N 285.387 3.345 70 20 CGID CCC(CC)CC(=O)Nc1ccc(S(=O)(=O)F)cc1 776362806 FNHQUKNIZMZPJR-UHFFFAOYSA-N 287.356 3.110 70 20 CGID COCCN(CC(F)(F)F)C(=O)C1CCC(C)(C)CC1 160046527 GWRKCGAHLNAKMV-UHFFFAOYSA-N 295.345 3.240 70 20 CGID Cc1cc(C)cc(NC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1 161010191 IDLRQBPKGWRZHC-ZBFHGGJFSA-N 288.391 3.383 70 20 CGID Cc1nc(C2(NCc3ccc(C)s3)CCCC2)no1 161366000 KCIANFYRTCIXKF-UHFFFAOYSA-N 277.393 3.307 70 20 CGID CCCCC(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C 161368571 PLZKTFRGWJGZAB-UHFFFAOYSA-N 261.325 3.415 70 20 CGID CC[C@H](N[C@H](CCO)CSC)c1ccc(F)cc1F 160288014 KQWMXDZEFGJFAN-RISCZKNCSA-N 289.391 3.120 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@@H]1CC=CCC1 160497281 FZWVOAABOMPOHU-CABCVRRESA-N 277.408 3.341 70 20 CGID CC[C@H](C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160752005 RWAKLNCXNVQUSX-STQMWFEESA-N 253.386 3.031 70 20 CGID CCCCCc1nnc(NC(=O)c2cccc(F)n2)s1 159661795 NSTZZBYVQGJAOJ-UHFFFAOYSA-N 294.355 3.057 70 20 CGID COCCOc1cccc(CNCCc2cccc(C)c2)c1 159904401 KWZSVWKNJYXOIS-UHFFFAOYSA-N 299.414 3.353 70 20 CGID C[C@@H](C(=O)Nc1cccc([S@@](C)=O)c1)c1cccs1 159739489 XLJFQAHMMKGORK-DGIBIBHMSA-N 293.413 3.228 70 20 CGID CCOc1ccc(NC(=O)[C@@H]2CC2(C)C)cc1F 159937589 KTTQUGDIABPZQF-JTQLQIEISA-N 251.301 3.209 70 20 CGID COC(=O)C[C@H](C)SC/C=C\c1ccccc1 217367571 WQFVMYLEPNLNSO-PWWFUAJNSA-N 250.363 3.385 70 20 CGID CCSCCN1CCC[C@@H]1c1cccc(C)n1 159702123 QUMWNHQBQRZZNX-CQSZACIVSA-N 250.411 3.280 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(OC)cs1 159791848 HIPDWJOUCVZGTN-ONGXEEELSA-N 253.367 3.065 70 20 CGID CCCOc1ccc(CNCCN(C)[C@@H](C)CC)cc1 217375210 LHYKWRRUMUQMFU-HNNXBMFYSA-N 278.440 3.295 70 20 CGID Cc1c(C(=O)Nc2ccc(Cl)nc2)cnn1CC(C)C 161093530 JWOKZFOFACUZQZ-UHFFFAOYSA-N 292.770 3.148 70 20 CGID FCCCSCc1noc(-c2ccsc2)n1 161480420 OXLSGAAKIAGQJY-UHFFFAOYSA-N 258.343 3.391 70 20 CGID Cc1cc(C)cc([C@@H](C)NC(=O)c2ccc(O)nc2C)c1 161480884 LEFFCIYQNCWSGS-GFCCVEGCSA-N 284.359 3.203 70 20 CGID C[C@@H]1CCCC[C@@H]1NC(=O)COc1ccc2[nH]ccc2c1 160018907 IPORJJHCZCHQHU-DOMZBBRYSA-N 286.375 3.242 70 20 CGID CSC[C@@H](CCO)N[C@H](C)c1cc(C)c(C)cc1C 160406271 OXUFSHUUFPSHBI-HUUCEWRRSA-N 281.465 3.376 70 20 CGID CC(=O)Nc1ccccc1CN(C)Cc1cccc(F)c1 160470585 BEYNTMOELOKFOP-UHFFFAOYSA-N 286.350 3.416 70 20 CGID CC(C)CN(CC(C)C)C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 160641015 LIPZGHZZIHGFJP-HZPDHXFCSA-N 296.455 3.268 70 20 CGID CC[C@H](C(=O)N(C)CCOCC1CC1)c1ccc(F)cc1 160965807 JJQKBUHEKMEJGC-INIZCTEOSA-N 293.382 3.204 70 20 CGID COc1ccc(N(C)C(=O)[C@@H]2C[C@H]2c2ccco2)cc1F 159835146 GPGVPAVQBLQMQN-VXGBXAGGSA-N 289.306 3.194 70 20 CGID CCc1nc(CNC(=O)NCC2(CC)CCCC2)cs1 159680557 CTVGFGHKWBQDNS-UHFFFAOYSA-N 295.452 3.475 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)Cc1ccc(OC)cc1OC 159494329 DMAXDIIQHHTEKL-YOEHRIQHSA-N 291.391 3.098 70 20 CGID CC[C@H](NC(=O)Nc1ccc2c(c1)CCC2)[C@H]1CCCO1 159510906 RHPIJJXAHCXAFA-JKSUJKDBSA-N 288.391 3.254 70 20 CGID CCCCN(C)C(=O)Nc1cnn(CCCC)c1C 159918375 ITJZCUXVOIPFPA-UHFFFAOYSA-N 266.389 3.255 70 20 CGID C[C@H]1C[C@H](NCCCc2cccc(F)c2)[C@H](C)CN1C 159767666 PBYQQYMIKQOYOK-KEYYUXOJSA-N 278.415 3.077 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1[nH]c(C)cc1C 159384876 LTGLILOBTSCKEA-AWEZNQCLSA-N 284.359 3.057 70 20 CGID CCSCC[C@H](C)NC1CCN(c2ccncc2)CC1 160055750 WMJIZSFPBGGFEO-AWEZNQCLSA-N 293.480 3.172 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1ccc(OC)cc1 160138053 RMWMWJKVBOCCGH-KGLIPLIRSA-N 264.413 3.076 70 20 CGID CN(C)C1(CNCc2cc(F)cc(Cl)c2)CCCC1 160976277 XLKQNFPDPKIXBS-UHFFFAOYSA-N 284.806 3.443 70 20 CGID CC(C)CN[C@H](CNC(=O)OC(C)(C)C)CC(C)C 218100784 OJCQWXCCVGXTOL-ZDUSSCGKSA-N 272.433 3.171 70 20 CGID Cc1noc(C)c1[C@@H](C)CC(=O)NCC1(C2CC2)CCC1 161294938 XZEXXHDFQJHOQD-NSHDSACASA-N 290.407 3.482 70 20 CGID CCCCNc1ccccc1C(=O)NC[C@@H](O)[C@H](C)CC 160039764 NBQXPFPSFSGGBZ-CZUORRHYSA-N 292.423 3.035 70 20 CGID CC[C@@H](NC(=O)c1cc(OC)cs1)c1c(C)noc1C 160039878 VLLXIIHVKZWSSH-LLVKDONJSA-N 294.376 3.243 70 20 CGID CCc1noc(CC)c1CNC(=O)N[C@@H](C)CC(C)C 160050197 UYRGOYYPUIKGDL-NSHDSACASA-N 281.400 3.033 70 20 CGID Cc1cccc([C@H]2CCCN2CCC(=O)OC(C)(C)C)n1 160256272 SDTDUJCOBRYXOF-OAHLLOKOSA-N 290.407 3.259 70 20 CGID CC(C)[C@@H]1CCCC[C@H]1Nc1ccc(OCC(N)=O)cc1 160306852 FYJSPEOLCRUCDN-JKSUJKDBSA-N 290.407 3.177 70 20 CGID C[C@@H]1CCN(C(=O)[C@H]2CCCCO2)c2ccccc2S1 160355307 GNXLFSCNANGSCE-TZMCWYRMSA-N 291.416 3.473 70 20 CGID O=C(CC1CC1)O[C@@H](c1ccccn1)C(F)(F)F 160400019 GNWCUVFAGPBABN-NSHDSACASA-N 259.227 3.028 70 20 CGID O=C(Nc1cc(Br)ccc1F)NC1CC=CC1 160505503 SDUUFHLUTMKMMX-UHFFFAOYSA-N 299.143 3.428 70 20 CGID C[C@H]1CN(Cc2noc(C3CCOCC3)n2)c2ccccc21 160792132 RWROQSQOCKDFBA-LBPRGKRZSA-N 299.374 3.087 70 20 CGID C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccc(OC(F)F)cc1 160862792 BMENNNVMGJNFSZ-MFKMUULPSA-N 299.317 3.034 70 20 CGID CC(C)OC1CCC(NC(=O)C2(C)CCC2)CC1 159443863 NRMQESSAVFJCER-UHFFFAOYSA-N 253.386 3.029 70 20 CGID Cc1ccccc1[C@@H](NC(=O)[C@@H](C)N)[C@@H]1CCC[C@H](C)C1 159687723 FOTRFUYDDSBBKO-CRNXPOROSA-N 288.435 3.326 70 20 CGID CCc1c(C(=O)NCc2ccccc2C)cnn1CC(C)C 159517815 DYVIWGQGNIOZFX-UHFFFAOYSA-N 299.418 3.340 70 20 CGID CCCOc1cccc(CCNC(=O)c2cc[nH]c2C)c1 159724737 GQXZKHKRNJGNDT-UHFFFAOYSA-N 286.375 3.084 70 20 CGID CN(CCSc1ccccc1F)C[C@H]1CCC[C@@H]1O 159840712 PDGVGYQRFLYYFA-OCCSQVGLSA-N 283.412 3.011 70 20 CGID Cc1cccc(CCNC(=O)N2C[C@H](C)C[C@@H](C)C2)c1 217404373 GAQADWVMOJHLPS-HUUCEWRRSA-N 274.408 3.225 70 20 CGID C[C@@H]1CC[C@H](CC(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237749 IVJQULABODPCMT-MNOVXSKESA-N 299.367 3.110 70 20 CGID CCS[C@H]1CCC[C@@H]1Nc1ccc(C(=O)OC)c(C)n1 218056353 BNTCGQPVBBKYMS-STQMWFEESA-N 294.420 3.263 70 20 CGID CN(C)[C@@H]1CCC[C@H](N[C@@H](Cc2ccccc2)C2CC2)C1 161013048 GKOULCFFAWKDSW-OTWHNJEPSA-N 286.463 3.470 70 20 CGID C1CCN(CCCN(C2CCCC2)C2CC2)CC1 161015133 YWSORZJXHSOSAF-UHFFFAOYSA-N 250.430 3.269 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@@H]1CCOC(C)(C)C1 161051712 AAFHVULFHJEJGS-GFCCVEGCSA-N 280.343 3.213 70 20 CGID CCc1ccc([C@@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)o1 161141381 VOKWHUBYCHUZIT-MCIONIFRSA-N 264.413 3.365 70 20 CGID CC(C)C[C@H]1CCCN(C(=O)Cc2ccccc2O)C1 161170704 LZLWNGDEKQMPJQ-CQSZACIVSA-N 275.392 3.219 70 20 CGID CCC(CC)(CN)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 161222866 SMQPDHJQFQVRCY-HZPDHXFCSA-N 288.435 3.204 70 20 CGID C1CCC(NC2(c3noc(C4CC4)n3)CCCC2)C1 161381426 LKFUJEPGRWISJX-UHFFFAOYSA-N 261.369 3.249 70 20 CGID CCCO[C@H]1CCCN(Cc2cnc3ccccn23)CC1 160275761 ACKFNGMXISEKHO-INIZCTEOSA-N 287.407 3.115 70 20 CGID CCCC1(CNC(=O)Cc2cn(C)c3ccccc23)CC1 160561837 RELLYWMLQACEAY-UHFFFAOYSA-N 284.403 3.417 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)C(=O)NCCc1cccs1 160586092 DSSMAPSGNWQYAM-KBPBESRZSA-N 296.480 3.163 70 20 CGID Cc1cccc(C)c1Cn1cnc(C(C)C)cc1=O 160921824 GLUMRRGTCHGBJF-UHFFFAOYSA-N 256.349 3.032 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CC[C@@H](C)[C@H]2C)n1 159694781 BAOCZWYWDWXKCT-CHWSQXEVSA-N 278.400 3.191 70 20 CGID CC(C)(C)c1nsc(N2C[C@H]3CCC[C@H]3C2)n1 159938607 JWEMEMCBMXFDOX-AOOOYVTPSA-N 251.399 3.072 70 20 CGID CCC(CC)(CC)NC(=O)Cc1nc(C)sc1C 159776777 WNDKFERMDQZIIZ-UHFFFAOYSA-N 268.426 3.387 70 20 CGID Cc1ccc(CCNC(=O)N2CCc3ccccc3C2)cc1 217225278 UUPWBKPEEWCCOT-UHFFFAOYSA-N 294.398 3.305 70 20 CGID Cc1ccccc1N(CC(=O)N[C@H](C)C(C)C)C(C)C 216924585 RBHOVZYIARHMGR-OAHLLOKOSA-N 276.424 3.371 70 20 CGID C[C@@H]1CCN(C(=O)c2ccnc(F)c2F)[C@H]2CCCC[C@H]21 218389535 VDZIRGYXOVFHBM-MDZLAQPJSA-N 294.345 3.401 70 20 CGID CCCCC(=O)O[C@@H](c1c(C)nn(C)c1C)C(F)(F)F 160103971 DHOREFMIVSNEJO-LBPRGKRZSA-N 292.301 3.374 70 20 CGID CC[C@@H](C)NC(=O)c1cccc(CN[C@H](C)C(C)C)c1 161067170 NFFNWOZCWADXCV-ZIAGYGMSSA-N 276.424 3.349 70 20 CGID COc1ccc(N(C)C(=O)CC[C@H]2CCCO2)cc1Cl 160132519 OAZZDMPMGFDRGN-GFCCVEGCSA-N 297.782 3.271 70 20 CGID CS[C@H](C)CC(=O)N[C@@H](C)Cc1ccccc1C 160324738 ONRAXUINGGBWJV-QWHCGFSZSA-N 265.422 3.184 70 20 CGID CCC[C@H](C)NCc1cncc(Br)c1 160557400 KABFMZVMANRJHB-VIFPVBQESA-N 257.175 3.122 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(-n2ccnc2)cc1 160816667 WMDSCLZERYISCR-GDBMZVCRSA-N 269.348 3.247 70 20 CGID CC(C)n1nccc1C(=O)N1CCSc2ccccc21 160843180 VGPQNISPNATYQX-UHFFFAOYSA-N 287.388 3.217 70 20 CGID C[C@H](CC(=O)N1CCC[C@H]2CCC[C@@H]21)c1ccncc1 160851693 MJKUQLOTYIXZOH-BMFZPTHFSA-N 272.392 3.366 70 20 CGID CN(C(=O)Nc1ccc2c(c1)CCC2)[C@H]1CCSC1 159509666 XKBVRYPYMBZKOV-AWEZNQCLSA-N 276.405 3.145 70 20 CGID Cc1cc(C(=O)Nc2nccs2)cc(C)c1F 160960099 PAHKJMSOQHQDIF-UHFFFAOYSA-N 250.298 3.151 70 20 CGID COC[C@@H](NCc1csc(-c2ccccc2)n1)C1CC1 161495988 QGWYEWNYWDCUSU-OAHLLOKOSA-N 288.416 3.325 70 20 CGID COC(=O)N1CC[C@H](c2cccc(Br)c2)C1 217246254 CWUNNYVVFGGROX-JTQLQIEISA-N 284.153 3.005 70 20 CGID Cc1cc(NC(=O)N[C@H]2CCCc3sccc32)no1 161181278 UNNFYMWBKXIKHP-JTQLQIEISA-N 277.349 3.244 70 20 CGID C[C@@H](NC(=O)NO[C@H]1CCCCO1)c1ccccc1Cl 161234334 AJNQMOQMBNRSIZ-MFKMUULPSA-N 298.770 3.158 70 20 CGID C[C@@H](Nc1nnc(C(F)(F)F)s1)c1cccnc1 160320553 IPXYKXGTCFESAY-ZCFIWIBFSA-N 274.271 3.125 70 20 CGID CC(C)(O)CN[C@H]1CCCCc2ccc(Cl)cc21 160623953 JPGVPHBLNPHSGQ-AWEZNQCLSA-N 267.800 3.468 70 20 CGID C[C@@H](N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccco1 160758440 AALOQMFCQJMTIZ-ZBFHGGJFSA-N 298.386 3.294 70 20 CGID CCCOc1cccc(CC(=O)N(C)Cc2ccncc2)c1 160816601 LEFPMDYUQNPFSK-UHFFFAOYSA-N 298.386 3.072 70 20 CGID CCc1noc([C@@H](C)N[C@H](C)c2cccc(F)c2F)n1 159513726 NYVJNDLOVBVMPD-RKDXNWHRSA-N 281.306 3.322 70 20 CGID Cc1ccc(C(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1 159372716 QEYCQEAZRDWIFN-QGZVFWFLSA-N 280.371 3.385 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Cc1c(C)noc1C 161027059 LXTOIONPKGHFMQ-HIFRSBDPSA-N 278.396 3.261 70 20 CGID C[C@@H]1CN(C(=O)NCc2cc3ccccc3[nH]2)CC[C@H]1C 161292846 YPMZJVXTBYGYPY-CHWSQXEVSA-N 285.391 3.355 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cccc(NC(C)=O)c1 160058094 FCKZGJBVFZNBEW-KBPBESRZSA-N 291.439 3.026 70 20 CGID CCOCCC1(CNC(=O)NCC2(CC(C)C)CC2)CC1 160184038 JUPGCMPCVIQUCS-UHFFFAOYSA-N 296.455 3.319 70 20 CGID COC[C@@H](NC(=O)Nc1cccc(CSC)c1)C1CC1 160241278 RIGNHUHVDLLGAF-CQSZACIVSA-N 294.420 3.096 70 20 CGID CC1(NC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)CCC1 160695992 HPNYFWUXPQMLFW-HUUCEWRRSA-N 288.391 3.149 70 20 CGID CCc1ccc(/C=C/C(=O)N[C@H](C)c2ncc(C)s2)o1 160837427 LJVAWHNVWDQANZ-WSKFYRRCSA-N 290.388 3.498 70 20 CGID O=C([C@@H]1CC=CCC1)N1CCc2c(F)cccc2C1 160844665 AGYUMGFBCKERSL-GFCCVEGCSA-N 259.324 3.067 70 20 CGID C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)[C@H]1CCCCO1 160849061 VXPBNOBMWFWVEI-WMLDXEAASA-N 287.403 3.383 70 20 CGID COc1ccc(CN(C)Cc2cnc3c(C)cccn23)cc1 159863131 SBXGBAAXYVSZRA-UHFFFAOYSA-N 295.386 3.283 70 20 CGID COc1ccc(N(C)C(=O)[C@H]2CC=CCC2)cc1F 159484710 ARFLUTWFQYJLDB-NSHDSACASA-N 263.312 3.153 70 20 CGID CC[C@@H](Nc1ccc(-c2csc(C)n2)cc1)C(=O)OC 159484992 APAKIFJKVXZFAB-CYBMUJFWSA-N 290.388 3.482 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CC[C@@H](C)[C@@H]2C)n1 159695028 BAOCZWYWDWXKCT-OLZOCXBDSA-N 278.400 3.191 70 20 CGID CC(C)CCc1nc(CN(C)C[C@H]2CCC[C@@H]2O)cs1 159767071 ZRYXSXCWRVETGR-HIFRSBDPSA-N 296.480 3.325 70 20 CGID CCOc1ccccc1NC(=O)NCC(CC)(CC)CO 159998288 SPHJNTCDBQCUFW-UHFFFAOYSA-N 294.395 3.006 70 20 CGID c1ccc2c(c1)NC[C@H]2c1nc([C@H]2CCCS2)no1 160588162 ZYQZRJIKILCQGS-ZYHUDNBSSA-N 273.361 3.195 70 20 CGID CC[C@@H](C)c1ccc(OCC(=O)NCC(F)(F)F)cc1 217341500 WMHXUESFFPPSLO-SNVBAGLBSA-N 289.297 3.257 70 20 CGID CCOC(=O)Nc1ccc(OCc2nccs2)cc1 161333244 COTVOYVTAGTLFS-UHFFFAOYSA-N 278.333 3.291 70 20 CGID CCOc1cc(C)ccc1NC(=O)N(C)[C@H]1CCSC1 161371537 IPPNCTNHEGVCMU-LBPRGKRZSA-N 294.420 3.363 70 20 CGID CC[C@@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccccc1 161414665 HZSPUWKXQZLRID-GDBMZVCRSA-N 295.448 3.019 70 20 CGID CS[C@H](C)CC(=O)N(C)[C@H](C)c1cccs1 160017769 XAXKDIQNJAUUQZ-NXEZZACHSA-N 257.424 3.409 70 20 CGID CC(C)[C@@H](NC(=O)[C@H]1CCCCO1)c1ccccc1 160232789 NYWDBUGYPAKWAG-HUUCEWRRSA-N 261.365 3.069 70 20 CGID CCOc1cccc(NC(=O)c2ccc(CN(C)C)cc2)c1 160667169 XJWCHMIADGNUCX-UHFFFAOYSA-N 298.386 3.399 70 20 CGID CC[C@@H](NC(=O)CCC1CCOCC1)c1c(C)noc1C 160719345 QULHIQWNTAWKHQ-CQSZACIVSA-N 294.395 3.066 70 20 CGID C[C@@H](CCC(=O)NC[C@H]1CCCC[C@@H]1O)c1ccccc1 160725473 RNYLFNKBVNNXKU-UAGQMJEPSA-N 289.419 3.238 70 20 CGID Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CC1(C)C 160943501 GALRRTOZNNRSQP-ZDUSSCGKSA-N 260.381 3.041 70 20 CGID Cc1cc(NC(=O)c2cc(Cl)ccc2Cl)c[nH]c1=O 159589890 YGWCCDUIROGSGV-UHFFFAOYSA-N 297.141 3.242 70 20 CGID O[C@H](Cc1ccccc1)CN(Cc1ccc(F)cc1)C1CC1 218760820 LESVBULOCRFKJC-LJQANCHMSA-N 299.389 3.394 70 20 CGID CC(C)(C)CC(=O)NC[C@@H]1CCCN1c1ccccc1 217806437 LOMJNPYAOZRSKS-HNNXBMFYSA-N 274.408 3.208 70 20 CGID CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)c1cccc(N)c1 217823174 CTFSYHYWKZJULK-WQVCFCJDSA-N 274.408 3.459 70 20 CGID C[C@@H]1CCC[C@H](CNCc2nn(C)c3ccccc23)C1 218135254 BMJNUCDHDYHWKO-KGLIPLIRSA-N 271.408 3.489 70 20 CGID COc1cccc(-c2noc([C@@H]3CCC(=O)C[C@@H]3C)n2)c1 161014137 LFWBHBLRYZCUMJ-IINYFYTJSA-N 286.331 3.218 70 20 CGID COCCC1(CNC(=O)N2CCCC[C@@H]2C(C)C)CC1 161029081 NBCHTUFWOZQXRF-CQSZACIVSA-N 282.428 3.023 70 20 CGID CNC(=O)c1ccc(COc2ccc(Cl)c(F)c2)cc1 161123985 AECDEQDHFCXWHP-UHFFFAOYSA-N 293.725 3.418 70 20 CGID C[C@H](NC[C@@](C)(O)c1ccsc1)C1CCCC1 160099701 VZTIHESBASRMNR-SMDDNHRTSA-N 253.411 3.124 70 20 CGID O=C(N[C@H]1CCO[C@@H](C2CC2)C1)N(C1CCCC1)C1CC1 160347570 UQHVDKBIJJWXDA-XJKSGUPXSA-N 292.423 3.061 70 20 CGID C[C@@H](CC1CC1)NC(=O)N1CCO[C@@H](c2cccs2)C1 160412730 ABLBVBSBXHETHN-WCQYABFASA-N 294.420 3.020 70 20 CGID CC(C)c1ccc(C(=O)N(C)c2ccc3c(c2)OCO3)cn1 160457649 IYCWNTPAEWOBBR-UHFFFAOYSA-N 298.342 3.210 70 20 CGID CCC(CC)n1nccc1C(=O)N[C@H](C)c1cccnc1 160672294 DEBAPXFQLGSTSC-GFCCVEGCSA-N 286.379 3.130 70 20 CGID CCN(CC(C)C)C(=O)c1cc(F)cc2cccnc12 159810464 HBELVGJOFRSWKD-UHFFFAOYSA-N 274.339 3.492 70 20 CGID CCn1nccc1CNCc1c(OC)ccc2ccccc12 159921755 RDYABDCUSQYKEU-UHFFFAOYSA-N 295.386 3.355 70 20 CGID CCN(C(=O)Nc1ccnc(C)c1Cl)C1CC1 159576571 OAKHGYQOPCDGJO-UHFFFAOYSA-N 253.733 3.060 70 20 CGID CC1(C)C[C@@H](Nc2nc(C(C)(C)C)ns2)CCO1 159995987 FTHPXVDFUAHWQV-VIFPVBQESA-N 269.414 3.205 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1 161112085 QXLNAJPHKDMFMR-RCBQFDQVSA-N 264.388 3.349 70 20 CGID O=S(=O)(Cl)CCCCCCOCc1ccccc1 112155100 XZVQNBPNSHBHID-UHFFFAOYSA-N 290.812 3.332 70 20 CGID CC1=CCN(C(=O)c2ccccc2Br)CC1 160175145 AZHKLECHAMHCIU-UHFFFAOYSA-N 280.165 3.241 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)CCc1cccnc1 161296004 VTBBACWKFZDMDA-HOTGVXAUSA-N 274.408 3.441 70 20 CGID CC(C)c1ccc(C(=O)NCCc2cccs2)cn1 160019740 ATJYNTLFCIQISV-UHFFFAOYSA-N 274.389 3.239 70 20 CGID CCC(N)(CC)CNC(=O)C(C)(C)c1cccc(Cl)c1 160423649 SEFYNQONYNQIMP-UHFFFAOYSA-N 296.842 3.251 70 20 CGID CCC(C)(C)NC(=O)[C@@H]1C[C@H]1c1sccc1C 160573378 IXRCQXPXASKRMR-GHMZBOCLSA-N 251.395 3.465 70 20 CGID CCC(CC)C(=O)Nc1cccc(OCCF)c1 160579206 UWOZWUFQOYJRSY-UHFFFAOYSA-N 253.317 3.410 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cccs1 160658870 PTFNFBPGELWVFF-LBPRGKRZSA-N 279.405 3.360 70 20 CGID CC(C)Cn1cc(NC(=O)C[C@@H](C)c2ccncc2)cn1 160796781 CKTNWSKDNNJAAC-CYBMUJFWSA-N 286.379 3.066 70 20 CGID COCc1ccccc1NC(=O)N[C@H](C)C1CCC1 160827522 XOZUEMHKQYLSJW-LLVKDONJSA-N 262.353 3.143 70 20 CGID C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C)[C@H](C)C1 160874111 AGRZORREFNATIS-MCIONIFRSA-N 290.407 3.011 70 20 CGID Cc1ccccc1[C@@H](CC(C)C)NC(=O)[C@@H]1CCCNC1 159693666 WXYLECHYZVPIEA-NVXWUHKLSA-N 288.435 3.198 70 20 CGID C1=C(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)COc2ccccc21 159558536 BEZYUXJZLKTFCM-SZMVWBNQSA-N 297.398 3.010 70 20 CGID CCOc1ccc([C@H](C)N[C@@H](CC)COC)cc1OC 159974935 HZEZJPUVOLJNFB-JSGCOSHPSA-N 281.396 3.170 70 20 CGID CCCCCNC(=O)NCc1ccc(Br)cc1 217315450 JOXTWGMRCMFICK-UHFFFAOYSA-N 299.212 3.439 70 20 CGID Fc1cc(Cl)ccc1NCc1nnc2n1CCCC2 217318470 BAWAMICRTNKMSI-UHFFFAOYSA-N 280.734 3.019 70 20 CGID CCOC(=O)[C@H](N[C@H]1CCCC[C@@H]1C)c1ccccc1 217683612 DLQSZMQDLAAFLV-CWRNSKLLSA-N 275.392 3.459 70 20 CGID Cc1cc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)nn1C 161170343 XBXADKGFOKPCEO-BFHYXJOUSA-N 275.396 3.274 70 20 CGID Cc1cnccc1CCNC(=O)NCCCC(C)(C)C 161450609 AMVJHOJFDKRNCR-UHFFFAOYSA-N 277.412 3.058 70 20 CGID CCc1nc(Cn2nc(C3CC3)nc2C2CC2)cs1 161511124 NKVABBAJSCRKBB-UHFFFAOYSA-N 274.393 3.100 70 20 CGID CCO[C@H]1C[C@@H](N(C)C(=O)NCCC(C)C)C12CCC2 160645585 PQVDPHFHMNNEAB-KGLIPLIRSA-N 282.428 3.022 70 20 CGID Cc1cc(F)cc(NC(=O)[C@@H]2CCC(=O)C[C@H]2C)c1 160662381 OIFOZPZOSVWOFM-QMTHXVAHSA-N 263.312 3.078 70 20 CGID Cc1c(CNCc2ccccc2OCC(C)C)cnn1C 160732126 HSCDJSREWSEHQN-UHFFFAOYSA-N 287.407 3.053 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccc(F)cc1 160821981 BVJLYRWIMWETHN-JTQLQIEISA-N 291.347 3.279 70 20 CGID CC(C)CC(=O)N[C@H]1CCOC2(CCCCC2)C1 160964615 YKXDDXNMSBTDSD-ZDUSSCGKSA-N 253.386 3.031 70 20 CGID CCCC[C@H](NC(=O)NCCc1cscn1)C1CCC1 159426028 WWEZVACVVRUGQB-AWEZNQCLSA-N 295.452 3.344 70 20 CGID Cc1ccccc1[C@H]1C[C@H](C)N(CCn2ccnc2)C1 159838811 HHKRLIPLENNQRG-HOTGVXAUSA-N 269.392 3.070 70 20 CGID C[C@H](NC(=O)[C@H]1CCCCO1)c1ccc(Cl)cc1 159943506 KEAIPKPPLSLCMB-GXFFZTMASA-N 267.756 3.086 70 20 CGID COCC(C)(C)NCc1ccc(F)c(C(F)(F)F)c1 160145526 ROZBYCDODBBIJY-UHFFFAOYSA-N 279.277 3.359 70 20 CGID CN1CCC(CCNCc2ccc(Cl)cc2F)CC1 160897611 ACBGWIJKUSNPNJ-UHFFFAOYSA-N 284.806 3.301 70 20 CGID C[C@H]1CN(CCOc2cc(Cl)ccc2Cl)CCO1 217512170 LMGXQLGGIBUSKC-JTQLQIEISA-N 290.190 3.093 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccc(F)cc1Cl 160838477 GRKFXSUMTRUXSB-UHFFFAOYSA-N 280.730 3.090 70 20 CGID C[C@H]1CCC[C@H]1CC(=O)Nc1ccc(S(=O)(=O)F)cc1 864237656 BUFCLGUDPMGSPL-QWRGUYRKSA-N 299.367 3.110 70 20 CGID COc1ccc([C@@H](C)NC(=O)NCc2ccccc2)cc1 217278199 NAOCZJGARMSBDY-CYBMUJFWSA-N 284.359 3.256 70 20 CGID COc1ccc([C@@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)cc1F 161039746 AKTPRSRBKBCNBO-YUELXQCFSA-N 294.414 3.358 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCC[C@H](N(C)C)C2)cc1F 161039869 AKTPRSRBKBCNBO-QEJZJMRPSA-N 294.414 3.358 70 20 CGID C[C@H]1Sc2ccccc2N(Cc2nccn2C)[C@@H]1C 161128827 BWIALLCXSNBBIW-VXGBXAGGSA-N 273.405 3.309 70 20 CGID CC(C)Oc1cncc(C(=O)N2CCC[C@H]3CCC[C@@H]32)c1 161318494 CTFIVJKUOPKJSD-CJNGLKHVSA-N 288.391 3.274 70 20 CGID C[C@@H]1Sc2ccccc2N(C(=O)[C@@H]2CCCO2)[C@@H]1C 160263560 ALNNSSUZZWFVPD-MDZLAQPJSA-N 277.389 3.081 70 20 CGID CC(C)Oc1cncc(C(=O)N[C@H]2CCc3ccccc32)c1 160307896 UOFUUAZRZKYOSW-KRWDZBQOSA-N 296.370 3.286 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(-c2csnn2)cc1 160712272 KTKYMBCRTRKEHQ-SECBINFHSA-N 293.417 3.285 70 20 CGID CCc1ccc(NC(=O)N(C)[C@@H]2CCSC2)cc1 159408463 ZAEXYFYJSFITEH-CYBMUJFWSA-N 264.394 3.218 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N(C)Cc1cccnc1 159467089 KNTSDPNKVZJACE-KGLIPLIRSA-N 286.400 3.214 70 20 CGID CC[C@H](C)C(=O)O[C@H](c1ccccn1)C(F)(F)F 159937037 SJHNCOFXMATZFJ-WCBMZHEXSA-N 261.243 3.274 70 20 CGID CC(C)c1ccc(C(=O)NCC2(O)CCCCCC2)cn1 159754361 XQBSSUNMTVGEII-UHFFFAOYSA-N 290.407 3.020 70 20 CGID CC[C@H](C)[C@H](O)CNC(=O)[C@@H](C)Cc1ccccc1Cl 159396299 LONURADEVUUKEF-SLEUVZQESA-N 297.826 3.042 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1cc(F)ccc1F 161019726 HASNSYCWBQBDHU-YUTCNCBUSA-N 282.378 3.488 70 20 CGID FC(F)(F)c1ccc(NCc2nnc3n2CCCC3)cc1 217317526 HYBOXEZEGVXAQN-UHFFFAOYSA-N 296.296 3.245 70 20 CGID CCc1noc(C)c1C[S@@](=O)c1ccc2c(c1)CCC2 161052453 NBGHLNIVPPKRAS-FQEVSTJZSA-N 289.400 3.342 70 20 CGID Cc1cnc([C@@H](C)NC(=O)C[C@@H](C)c2ccncc2)s1 161287529 GOMLFVJYQGSVGD-ZYHUDNBSSA-N 289.404 3.218 70 20 CGID Cc1ccc(F)c(OCC(=O)N2CCC[C@H]3CCC[C@@H]32)c1 161328962 KLLKQHFISHGRJH-HIFRSBDPSA-N 291.366 3.304 70 20 CGID O=C(CCCN1C[C@H]2CCC[C@@H]2C1)c1ccccc1 160039196 FLHWJOLJAZMEJK-HZPDHXFCSA-N 257.377 3.381 70 20 CGID CC(C)[C@@H](NC(=O)N[C@@H](C)CCO)c1ccccc1Cl 160090913 GVYGXJPZFDAFIF-SMDDNHRTSA-N 298.814 3.107 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1OC 160142030 HEROGYQGGWJHBI-PZSREKOKSA-N 291.391 3.317 70 20 CGID C[C@@H]1CC(NC(=O)Nc2cccc3[nH]ccc23)C[C@@H](C)O1 160215741 XASGNNCYXVQUBX-GHMZBOCLSA-N 287.363 3.245 70 20 CGID CC[C@H](NC(=O)c1ccoc1C)c1c(C)noc1C 160486335 QULKXSCLXYWSEZ-LBPRGKRZSA-N 262.309 3.074 70 20 CGID CC1(C)C[C@@H](NCc2cccc3c2OC(C)(C)C3)CCO1 160500791 CCBRFXVYAFUQIH-HNNXBMFYSA-N 289.419 3.447 70 20 CGID CCCCC(=O)N[C@H]1CCOC2(CCCCC2)C1 160559335 CDWLHURQPNNQRA-ZDUSSCGKSA-N 253.386 3.175 70 20 CGID CC[C@H](C)[C@@H](C)NCc1ccc(CN2CCOCC2)cc1 160572636 XROTXJYZPHPOHX-JKSUJKDBSA-N 290.451 3.043 70 20 CGID CCCC1(CNC(=O)c2cnc(-c3ccccc3)nc2)CC1 160568025 PWMDULZDZYBQRZ-UHFFFAOYSA-N 295.386 3.454 70 20 CGID CCc1ccc(NC(=O)N(C)[C@H]2CCSC2)cc1 159408590 ZAEXYFYJSFITEH-ZDUSSCGKSA-N 264.394 3.218 70 20 CGID CC(C)(C)c1nsc(NC[C@](C)(O)c2ccsc2)n1 159605034 FUCRGDJJUUTCAJ-ZDUSSCGKSA-N 297.449 3.217 70 20 CGID COc1ccc([C@H](NCc2cn(C)nc2C)C(C)C)cc1 159638706 RENJWQCOJWCJRR-QGZVFWFLSA-N 287.407 3.224 70 20 CGID CC(C)(C)NC(=O)CN[C@@H]1CCC(C)(C)c2ccccc21 159851175 OAPZORJLKJHYKP-OAHLLOKOSA-N 288.435 3.303 70 20 CGID COc1cc(CCC(=O)N[C@@H](C)C(C)C)ccc1Cl 159722003 JJVOCSVSMGDZRK-NSHDSACASA-N 283.799 3.442 70 20 CGID C[C@H](C(=O)Nc1cccc([S@](C)=O)c1)c1cccs1 159739058 XLJFQAHMMKGORK-APBUJDDRSA-N 293.413 3.228 70 20 CGID COCC[C@H](Cc1cccc(F)c1)N[C@H]1CCCSC1 159542992 MWWLRGRWPAGHQV-CVEARBPZSA-N 297.439 3.259 70 20 CGID COc1ccc2nc(NC(=O)N3CCCCC3)sc2c1 160314997 XDTRBIGNAKZDRH-UHFFFAOYSA-N 291.376 3.323 70 20 CGID Cc1nc2c(n1CC(=O)c1ccc(F)cc1F)CCCC2 216708977 OIHSKPAVJPVFPO-UHFFFAOYSA-N 290.313 3.231 70 20 CGID O=C(NCCc1ccc(-c2ccccc2)cc1)C1CC1 160030110 UOBNCGBXRFYUKN-UHFFFAOYSA-N 265.356 3.422 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@@H]1c1ccc(F)cc1 160200210 DUVBFMGHQDJVSU-CABCVRRESA-N 273.351 3.236 70 20 CGID Cc1cccc(C)c1CNc1ccc(N2CCNC2=O)cc1 160418812 JRMRFRIPYNYMHF-UHFFFAOYSA-N 295.386 3.445 70 20 CGID CCCC1(CNC(=O)c2cc(F)cc3[nH]cnc23)CC1 160610301 IRNXYRXLEDTHRT-UHFFFAOYSA-N 275.327 3.012 70 20 CGID CC(C)CSCCCNC(=O)c1cnn(C(C)(C)C)c1 160758705 IRIFFXWPWKMZIR-UHFFFAOYSA-N 297.468 3.147 70 20 CGID CCSCC[C@@H](C)NC(=O)C[C@H](C)c1ccncc1 160927067 KZSNYZHLXSZZCS-QWHCGFSZSA-N 280.437 3.223 70 20 CGID CCCCn1ncc(C(=O)N2CCCC[C@@H]2C)c1C 159626564 UGYKLHNPZDBCRP-LBPRGKRZSA-N 263.385 3.006 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2NC(=O)N1CCCCCC1 159445011 LCJGYFFAAIOMAW-MRXNPFEDSA-N 287.407 3.232 70 20 CGID CC[C@@H](C)[C@H](C)N(C(=O)NCCc1cscn1)C1CC1 159551570 TWFAHKICDQGPIQ-NEPJUHHUSA-N 295.452 3.294 70 20 CGID c1ccc2c(c1)NC[C@H]2c1nc([C@@H]2CCCS2)no1 160587918 ZYQZRJIKILCQGS-PWSUYJOCSA-N 273.361 3.195 70 20 CGID CCCN1CCC(NCc2cc(F)cc(Cl)c2)CC1 160824172 FQJRRDDLMJXJCA-UHFFFAOYSA-N 284.806 3.443 70 20 CGID Cc1cc(C(=O)N2CCOc3cc(F)ccc32)oc1C 161143306 VNSOSPMEPRSTQB-UHFFFAOYSA-N 275.279 3.075 70 20 CGID CC(=O)N1CCSc2ccc(C(F)(F)F)cc21 161371497 OGFNVFJUMMUUJR-UHFFFAOYSA-N 261.268 3.164 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCC(=O)N(C)Cc1ccccc1 161412832 DRJMBMAGCKWTIR-SJORKVTESA-N 288.435 3.203 70 20 CGID Cc1cccc(CCNC(=O)Nc2nc(C)cs2)c1 160017387 FRBJEMWJWNXHPP-UHFFFAOYSA-N 275.377 3.124 70 20 CGID CCC1(CC)[C@@H](N[C@@H](C)c2cccnc2)C[C@H]1OC 160110089 PYSKPZJXSUEWBK-AEGPPILISA-N 262.397 3.326 70 20 CGID O=C(NCC1(C2CC2)CC1)[C@H]1C[C@H]1c1ccc(F)cc1 160200055 DUVBFMGHQDJVSU-GJZGRUSLSA-N 273.351 3.236 70 20 CGID Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(C(C)C)cc1)CC2 160302051 MGQWKLCXWUSOBZ-GUYCJALGSA-N 298.434 3.376 70 20 CGID Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(C(C)C)cc1)CC2 160302322 MGQWKLCXWUSOBZ-DYVFJYSZSA-N 298.434 3.376 70 20 CGID COc1cc(N[C@H](C)C(=O)Nc2ccccc2)ccc1F 160310479 KPGWDDLAKSJCLC-LLVKDONJSA-N 288.322 3.273 70 20 CGID C[C@H](Cc1cccc(F)c1)C(=O)N(C)Cc1cccn1C 160474804 YOVFUJVAADIIFL-CYBMUJFWSA-N 288.366 3.001 70 20 CGID C[C@H](C(=O)NCCc1cccs1)c1c(F)cccc1F 160547622 WMIMCJDLYMVWPX-JTQLQIEISA-N 295.354 3.489 70 20 CGID COC[C@H](C)NCc1cn(-c2ccccc2)nc1C(C)C 160749633 QTWNCBJVPZUDCP-AWEZNQCLSA-N 287.407 3.120 70 20 CGID CC(C)CCNC(=O)NC1(c2cccc(F)c2)CC1 160849564 VPTQLXUTXBRTKG-UHFFFAOYSA-N 264.344 3.160 70 20 CGID Cc1nc(C)c(CCNC(=O)[C@@H](C)c2cccs2)s1 159503671 PXWGNMJIIHXZDM-VIFPVBQESA-N 294.445 3.284 70 20 CGID CC(=O)C[C@H](C)NC(=O)c1occc1-c1ccccc1 159964529 KGSQYTZXFPQDJM-NSHDSACASA-N 271.316 3.044 70 20 CGID CCCCOCCCNc1ccc(S(=O)(=O)CC)cc1 160356971 BFJGUHIXOAWMLI-UHFFFAOYSA-N 299.436 3.099 70 20 CGID COc1ccccc1[C@@H](C)N[C@H]1CCC[C@H](N(C)C)C1 161055513 ARSNRRJLBKMKHQ-ILXRZTDVSA-N 276.424 3.219 70 20 CGID Cc1cc(N[C@H](CO)CC(C)(C)C)nc(C(C)C)n1 161430119 CZXGJFRQFZOJGG-LBPRGKRZSA-N 265.401 3.117 70 20 CGID COc1ccc(C(C)(C)C)cc1NC(=O)C(F)F 217648561 CCXGKMZFCCOFPE-UHFFFAOYSA-N 257.280 3.196 70 20 CGID CC(C)[C@@H](C)CC(=O)N1CCc2c(F)cccc2C1 161074027 BHXGWWHCSIAXRQ-LBPRGKRZSA-N 263.356 3.393 70 20 CGID Cc1cc(C)cc(C[C@@H](C)NC(=O)c2ccc(N)cc2)c1 161346868 QTSYPENGMZVWFR-CQSZACIVSA-N 282.387 3.247 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)N1CCCCC1 160003731 ODOXSWYAHXWCTK-LBPRGKRZSA-N 296.436 3.180 70 20 CGID CCC[C@@H](N[C@@H](CCO)CSC)c1ccc(OC)cc1 160185170 UWYSVYIDRQKBMT-GOEBONIOSA-N 297.464 3.240 70 20 CGID CC[C@H]1CCCN(C(=O)c2c(C(C)C)nn(C)c2Cl)C1 160319565 PBJDMSKPCPSHPV-NSHDSACASA-N 297.830 3.459 70 20 CGID CCS(=O)(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 160346459 XZZKEAOOEQGLOM-DZGCQCFKSA-N 281.421 3.118 70 20 CGID COc1cc(C(=O)N(C)c2ccc3c(c2)OCO3)ccc1C 160544537 RYLUCEOKOXRUFV-UHFFFAOYSA-N 299.326 3.009 70 20 CGID CCc1nsc(N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 160679732 CIOAMJANJBGFFQ-QWHCGFSZSA-N 289.404 3.433 70 20 CGID CC(C)n1cc([C@H](C)N[C@@H]2CCCSC2)cn1 159640342 DUUCOPYVURJWQW-WCQYABFASA-N 253.415 3.010 70 20 CGID CCC[C@@H]1CN(C(=O)[C@@H](c2ccccc2)C2CC2)CCO1 159460894 QPLLGIDKODOQRE-SJORKVTESA-N 287.403 3.208 70 20 CGID COC[C@H](NCc1c(C)nn(-c2ccccc2)c1C)C1CC1 159874697 COVYIUIAHDMJPH-SFHVURJKSA-N 299.418 3.004 70 20 CGID NC1(CC(=O)Nc2cc(C3CCCCCC3)[nH]n2)CCC1 159480362 SSVJWAVNJOIUJH-UHFFFAOYSA-N 290.411 3.058 70 20 CGID COCC[C@@H](Cc1cccc(F)c1)N[C@@H]1CCCSC1 159542559 MWWLRGRWPAGHQV-JKSUJKDBSA-N 297.439 3.259 70 20 CGID CCOC(=O)CN(Cc1cccc(OC)c1)C1CCCC1 159776185 FVJMIJCMYSEVNB-UHFFFAOYSA-N 291.391 3.003 70 20 CGID Cc1cccc([C@@H](C)NC2C[C@@H]3CC[C@H](C2)N3C)c1 160131684 TVXZAXGVTCQAOF-HZTRTUMWSA-N 258.409 3.271 70 20 CGID Oc1cccc(CNc2ncccc2C(F)(F)F)c1 160815620 LZUFXZHUKRKSJH-UHFFFAOYSA-N 268.238 3.418 70 20 CGID CC(C)(C)OC(=O)N1CCC[C@H]1c1cccc(O)c1 218509099 FYFJVOMMAZSCJD-ZDUSSCGKSA-N 263.337 3.464 70 20 CGID C[C@H](NC[C@@H](C)N(C)Cc1ccccc1)C1(C)CC1 160883880 BHLILOHZNXTQLV-CABCVRRESA-N 260.425 3.285 70 20 CGID C[C@H]1CCC[C@H](NC(=O)c2ccnc(Cl)c2F)C1 161412742 DGMUWDMKRPYYHD-IUCAKERBSA-N 270.735 3.183 70 20 CGID Cc1cc(C(=O)N(C)Cc2cccn2C)ccc1Cl 160504547 CBUJUQRYGWWLGV-UHFFFAOYSA-N 276.767 3.259 70 20 CGID Cc1ccsc1CCCC(=O)N1C[C@@H](C)OC[C@@H]1C 161132945 HEAQUOXXSYDOAY-QWHCGFSZSA-N 281.421 3.015 70 20 CGID Cc1ccc(NC(=O)[C@@H]2CCCN2)cc1OCCC(C)C 161509860 YFDLUZNLUPDQAF-HNNXBMFYSA-N 290.407 3.110 70 20 CGID FC(F)(F)CCCNc1nnc(C(F)(F)F)s1 160179198 BCDQWUKBRZUPSE-UHFFFAOYSA-N 279.209 3.311 70 20 CGID C[C@H](N[C@H]1CCCN(c2ccccc2F)C1=O)C1CCC1 160215939 IFLKJHUDSNBEMC-WFASDCNBSA-N 290.382 3.099 70 20 CGID COc1cc(NCCc2ccc3c(c2)CCO3)ccc1F 160301576 UFABIZIJGMMENL-UHFFFAOYSA-N 287.334 3.424 70 20 CGID O=C(NOCc1ccc(C(F)(F)F)cc1)C1CCC1 160622400 YQPOZWGFEJITGX-UHFFFAOYSA-N 273.254 3.053 70 20 CGID O=C(Nc1cccnc1)C1(Cc2ccccc2)CCC1 160710766 VCDKFXIIIZIVRL-UHFFFAOYSA-N 266.344 3.433 70 20 CGID CCCOC1(CNC(=O)CO[C@@H](C)CC)CCCCC1 160949914 DRWKMQBKWWYETE-AWEZNQCLSA-N 285.428 3.047 70 20 CGID CC(C)(C)c1ccc(CNC(=O)[C@@H]2CCCCO2)cc1 160975923 HXEPLWQWAWUFCN-HNNXBMFYSA-N 275.392 3.169 70 20 CGID C[C@H]1CSc2ccccc2N(C(=O)[C@@H]2CCCOC2)C1 159523530 ZEFVKPLSXJYRNV-CHWSQXEVSA-N 291.416 3.188 70 20 CGID C[C@H](N[C@H]1CCOC(C)(C)C1)c1nc2ccccc2n1C 159935068 GRMKFTXSBIVWQK-STQMWFEESA-N 287.407 3.182 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H]2CCN(C)[C@H](C)C2)C1 159377615 ZERAIUAXYKNGKX-KBUPBQIOSA-N 270.486 3.123 70 20 CGID Cc1ccccc1[C@H](C)N[C@@H]1CCN(c2ncccc2F)C1 159788213 TVZZMDCWINJTOY-LSDHHAIUSA-N 299.393 3.459 70 20 CGID CCCn1nccc1CNCc1ccccc1CC 160156527 DYCKCHLTXJWAGR-UHFFFAOYSA-N 257.381 3.145 70 20 CGID CNC(=O)c1cccc(NCc2ccc(Cl)cc2F)c1 160661644 NIADOLOATJNEDM-UHFFFAOYSA-N 292.741 3.451 70 20 CGID CCOCC(=O)Nc1ccccc1-c1csc(C)n1 218591066 KCEYWHQLLLGYCM-UHFFFAOYSA-N 276.361 3.094 70 20 CGID Clc1ccccc1[C@H]1CN(CCOCC2CC2)CCO1 160559677 SZUJJPMKKHOIBZ-MRXNPFEDSA-N 295.810 3.140 70 20 CGID COC(=O)c1ccnc(NC[C@H]2CCC[C@H](C)C2)c1 217929426 UVYJNYUUWBAEKH-RYUDHWBXSA-N 262.353 3.106 70 20 CGID COCCN1CCC(c2ccccc2Br)CC1 217258811 VEEHBPXUNAOEIY-UHFFFAOYSA-N 298.224 3.275 70 20 CGID CC[C@@H](C)NC(=O)COc1ccc([C@H](C)CC)cc1 217342071 KQLQCABYJIISAI-CHWSQXEVSA-N 263.381 3.494 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1c(C)noc1C 161243871 JZYBEMURUIQGEO-OLZOCXBDSA-N 264.369 3.332 70 20 CGID CCOc1ccc(CN(CC)CCCn2ccnc2)cc1 161246811 YNYUGGSRWSJQHT-UHFFFAOYSA-N 287.407 3.194 70 20 CGID C[C@H](CC(=O)c1cccs1)NC(=O)[C@@H]1CC=CCC1 160874052 NOGKDKDSRLIYBO-VXGBXAGGSA-N 277.389 3.182 70 20 CGID CCC(CC)CS(=O)(=O)N(C)[C@H](CC)c1ccncc1 159714331 SNKZRNLAPCCFSF-OAHLLOKOSA-N 298.452 3.231 70 20 CGID CCCCOCCCNCc1cccc2c1NCCC2 160210039 NOIKRQOCRYHPJM-UHFFFAOYSA-N 276.424 3.341 70 20 CGID CCN(CC)c1ncc(CN[C@@H]2CCOC(C)(C)C2)s1 160478669 DMBKLQXZDUPMQE-GFCCVEGCSA-N 297.468 3.037 70 20 CGID CCC(CC)(CN)C(=O)N1CCSC2(CCCCC2)C1 161248092 JUXCZNQJHLQDTM-UHFFFAOYSA-N 298.496 3.030 70 20 CGID Cc1cccc(COc2c(C)cc(CNCCO)cc2C)c1 217223483 ZYNNOZWXTKKBJL-UHFFFAOYSA-N 299.414 3.273 70 20 CGID CCN(CC)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 217795212 NYHWHDCODVERDM-STQMWFEESA-N 296.208 3.421 70 20 CGID O=C(NC1CC=CC1)C1(c2ccc(F)cc2)CCCC1 161068627 UKIZJFWUQWSRKB-UHFFFAOYSA-N 273.351 3.472 70 20 CGID c1ccc(-c2noc(CSCc3cscn3)n2)nc1 161249850 TYQVASJVBDKROX-UHFFFAOYSA-N 290.373 3.022 70 20 CGID CC1(NC(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)CCC1 161317029 RKINOWYQBVCJJP-CABZTGNLSA-N 280.318 3.063 70 20 CGID CCOc1ccc(NC(=O)N(C)[C@H]2CCSC2)cc1F 161456502 PTNLCTJKDSJYPI-NSHDSACASA-N 298.383 3.194 70 20 CGID O=C(CCc1ccc(Cl)c(Cl)c1)Nc1cn[nH]c1 160129490 CFUQQTDNRIWSAL-UHFFFAOYSA-N 284.146 3.288 70 20 CGID Cc1nc2ccc(NC(=O)N(C)[C@@H]3CCSC3)cc2o1 160361567 PMNQSZFZCPRDNK-LLVKDONJSA-N 291.376 3.105 70 20 CGID Cc1ccc2c(c1)[C@H](NC(=O)N[C@H](C)CC(C)C)CO2 160531616 GNUHIRPPISAUNM-TZMCWYRMSA-N 276.380 3.162 70 20 CGID CCCCn1ncc(C(=O)N2[C@H](C)CCC[C@H]2C)c1C 160765756 HOHNNVWAXUBCTF-CHWSQXEVSA-N 277.412 3.395 70 20 CGID O=C(CCCN[C@@H]1CCSC1)Nc1ccc(Cl)cc1 160801159 CPJYYLAUANPVID-CYBMUJFWSA-N 298.839 3.154 70 20 CGID CCCc1cc(C(=O)NOCc2cccnc2)sc1C 160807515 MNYLERRDTQTWCL-UHFFFAOYSA-N 290.388 3.266 70 20 CGID CCn1nccc1CN[C@@H](C)c1ccc(OC(F)F)cc1 159920650 HJOYJEJRYRHEDC-NSHDSACASA-N 295.333 3.355 70 20 CGID Cc1ccc(CNC(=O)NC[C@@]2(C)CCCS2)s1 159970922 XHSGETXVODSOPR-CYBMUJFWSA-N 284.450 3.141 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)NCc1ccc2ccccc2c1 159780828 CFYBLFPHSKYWPK-ACJLOTCBSA-N 295.382 3.461 70 20 CGID CCOCCCN1CCC(OC2CCCCC2)CC1 159890215 GRDHUQHFEYHNEH-UHFFFAOYSA-N 269.429 3.227 70 20 CGID CCCC[C@@H](CN)NC(=O)c1cc2ccc(F)cc2s1 161215148 UGFBNZBKZKGJCW-LBPRGKRZSA-N 294.395 3.288 70 20 CGID CCS[C@@H]1CCC[C@@H]1Nc1ncnc2c1CCCC2 217811577 QRNKXZMRHSFBDW-UONOGXRCSA-N 277.437 3.442 70 20 CGID CN(Cc1cccn1C)C(=O)c1ccccc1OC1CCC1 161003009 HQMSTPMJJSSXAK-UHFFFAOYSA-N 298.386 3.229 70 20 CGID CCN(Cc1ccccn1)[C@H](C)c1nc(C(C)C)no1 161182157 ZJOJQHSBWIOXOB-GFCCVEGCSA-N 274.368 3.171 70 20 CGID CCCN(CCO)Cc1cccc(OC2CCCC2)c1 161202032 GZYMBYQVXBDQNQ-UHFFFAOYSA-N 277.408 3.212 70 20 CGID CC1(NC(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)CCC1 161317163 RKINOWYQBVCJJP-BXKDBHETSA-N 280.318 3.063 70 20 CGID Cc1ccc(C(=O)CCN[C@H](CCO)c2ccccc2)cc1 161436171 DVYZLVURMKITRI-GOSISDBHSA-N 297.398 3.281 70 20 CGID Cc1nc(C(C)(C)NCCCN2CCCCC2)sc1C 161437802 MNMQVIJAUAJXAO-UHFFFAOYSA-N 295.496 3.461 70 20 CGID COc1ccc(CC[C@H](C)NCC2(CO)CCCC2)cc1 160080640 YHRAAHGBMOLMDP-HNNXBMFYSA-N 291.435 3.159 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccccc1N1CCCC1=O 160186215 QUTYRMJMMSAZPC-YVEFUNNKSA-N 286.375 3.188 70 20 CGID O=C(N[C@@H]1CCSc2c(F)cccc21)[C@@H]1CCCCO1 160307929 KPKVXIQJMMCRGL-OLZOCXBDSA-N 295.379 3.048 70 20 CGID OCCC[C@H](NC(C1CC1)C1CC1)c1ccccc1 160726672 GFGORNVMGZJFEC-INIZCTEOSA-N 259.393 3.278 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CCCCCc1cccs1 160861197 ZXWCRBRKGVFKMK-AWEZNQCLSA-N 297.464 3.374 70 20 CGID C[C@H](NC(=O)c1ccc(CN)cc1)[C@H](C)c1ccccc1 160892009 DOSNZMNVYZZPQH-KBPBESRZSA-N 282.387 3.067 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1c1nc(-c2ccc(F)c(F)c2)no1 160996982 JYCMEZLOVRPXLN-KWQFWETISA-N 292.285 3.488 70 20 CGID Cc1cc(NC(=O)C[C@@H]2C[C@H](C)CC(C)(C)C2)c[nH]c1=O 159650165 GLHXAOZVCGKUCT-AAEUAGOBSA-N 290.407 3.474 70 20 CGID CCN(Cc1nc2ccccc2c(=O)[nH]1)C[C@H]1CC=CCC1 159881938 OTRXPVZYJFESFD-AWEZNQCLSA-N 297.402 3.101 70 20 CGID CCCc1ncc(C(=O)NCC2(C3CC3)CC2)s1 159722684 VIHQCYBEESXLRD-UHFFFAOYSA-N 264.394 3.016 70 20 CGID C[C@H]1C[C@@H](NCCCc2cccc(F)c2)[C@H](C)CN1C 159767922 PBYQQYMIKQOYOK-JKIFEVAISA-N 278.415 3.077 70 20 CGID CC1(C)C[C@@H]1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 159573111 HXFIFHVXRJLYPE-NUEKZKHPSA-N 287.403 3.317 70 20 CGID COc1ccc([C@@H](C)NCC2(CO)CCCC2)c(F)c1 160074666 BACMMHKKYQECEW-GFCCVEGCSA-N 281.371 3.038 70 20 CGID Cc1ccc(CCNC(=O)N[C@H]2CCCC[C@@H]2C)cc1 217307834 IOLWPNDQDLZWKP-HOCLYGCPSA-N 274.408 3.415 70 20 CGID C[C@H]1CCC[C@H](C(=O)Nc2ccc3c[nH]nc3c2)C1 159766597 IFTITLFRGPYCLQ-QWRGUYRKSA-N 257.337 3.328 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CCc1cccnc1 161296220 VTBBACWKFZDMDA-JKSUJKDBSA-N 274.408 3.441 70 20 CGID CC[C@H](S[C@H](CC)C(N)=O)c1ccc(F)cc1 161339488 JYUJCWYGIBBROR-NWDGAFQWSA-N 255.358 3.274 70 20 CGID CCC[C@@H]1CCCN(C(=O)NCc2ccc(OC)cc2)C1 161423142 HOFZCYMSGPTPMU-OAHLLOKOSA-N 290.407 3.417 70 20 CGID COc1ccc([C@H](NC(=O)[C@H]2CCCCO2)C(C)C)cc1 160230948 JBQJEZVMYAJXKU-HZPDHXFCSA-N 291.391 3.078 70 20 CGID O=C(C[C@@H]1CCCCO1)N[C@H]1CCCc2sccc21 160269448 XIYXGCFJXPTOFT-AAEUAGOBSA-N 279.405 3.201 70 20 CGID Cn1cc(Nc2cccc(C(=O)N[C@H]3C=CCCC3)c2)cn1 160381812 CYHLOPCLGCFSGB-AWEZNQCLSA-N 296.374 3.002 70 20 CGID C[C@H]1CCC[C@H](C(=O)N2CCO[C@H](c3ccccc3)C2)C1 159687712 BROHCDNPAQBBLN-XIRDDKMYSA-N 287.403 3.413 70 20 CGID Cc1ccc2nc(NC(=O)[C@@H]3CCCCO3)sc2c1 159546035 IMWSZCWYQJAASV-NSHDSACASA-N 276.361 3.112 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)c1cc(OC)cs1 159792097 HIPDWJOUCVZGTN-GXSJLCMTSA-N 253.367 3.065 70 20 CGID CC(C)[C@H](N)c1noc(C2C3CC4CC(C3)CC2C4)n1 160249746 QPXOHQHNXNHGTH-IXKAHESDSA-N 275.396 3.265 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2ncc(C)o2)n1 160134984 IPNICZKGWMYLGC-CQSZACIVSA-N 257.337 3.024 70 20 CGID Cn1nccc1CSc1nc2ccc(Cl)cc2[nH]1 161175935 SVDICBXZDRWTTC-UHFFFAOYSA-N 278.768 3.242 70 20 CGID Cc1ccc(NC(=O)N2C[C@H]3CCCC[C@H]3C2)cn1 161320370 WBKFAKQVVXOBNJ-BETUJISGSA-N 259.353 3.044 70 20 CGID Cc1ccccc1CNC(=O)c1ccc(C(C)C)nc1 160042625 FZLXCUJYNOXACM-UHFFFAOYSA-N 268.360 3.443 70 20 CGID CCCC(=O)N1CCC[C@@H]1C(=O)N(CC)CC(CC)CC 160209724 RQEAJEVNPCRLJU-OAHLLOKOSA-N 296.455 3.062 70 20 CGID O=C(NCc1ccn(C2CCCC2)n1)Nc1ccsc1 160505299 GZGZHJIKODBADU-UHFFFAOYSA-N 290.392 3.381 70 20 CGID Cc1cnc(N[C@@H]2CCO[C@H](c3ccccc3)C2)nc1C 160615534 UBUHNBUQMNWYGI-CVEARBPZSA-N 283.375 3.426 70 20 CGID CCc1cc(O)nc(CN2CCC[C@@H]2c2ccccc2)n1 160633592 XNZINYRZSAFGQW-OAHLLOKOSA-N 283.375 3.082 70 20 CGID FC(F)(F)C1CCN(Cc2cnc3ccccn23)CC1 160864561 YGLNXORNMSMLHQ-UHFFFAOYSA-N 283.297 3.109 70 20 CGID CCN(Cc1cccnc1C)C[C@H]1COc2ccccc2O1 160955311 XXRLRTJSWCWTDS-INIZCTEOSA-N 298.386 3.052 70 20 CGID Cc1cccc([C@H](NC(=O)[C@@H]2C[C@@H]2C)c2ccccn2)c1 159900617 AGZCEYBENJKCEG-LXZKKBNFSA-N 280.371 3.252 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cccc2c1CCC2 159987341 FSNPXMWUVYDPEW-OAHLLOKOSA-N 299.414 3.397 70 20 CGID CCN(Cc1ccccc1)Cc1nccn1C(C)C 160678820 ROSAZTNJIQUSLI-UHFFFAOYSA-N 257.381 3.486 70 20 CGID Cc1ncc(-c2cccc(OCCN(C)C)c2)s1 218054008 KJRGWYOFFPWFID-UHFFFAOYSA-N 262.378 3.059 70 20 CGID Cc1ccc([C@H](O)Cn2c(C)nc3c2CCCC3)cc1 216916193 ZTFSFBLISZKDHU-QGZVFWFLSA-N 270.376 3.112 70 20 CGID CC[C@H](CC1CCCCC1)C(=O)N[C@H]1CCC[C@H](N)C1 161035941 WYLWTXIQDDAYLY-PMPSAXMXSA-N 280.456 3.369 70 20 CGID C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)C1CCCCC1 161225013 PCKDTWYERCQEOO-GFCCVEGCSA-N 291.366 3.484 70 20 CGID CCC(N)(CC)CNC(=O)[C@H](C)c1ccc(Cl)s1 160442651 GZOBEPLRWUBJNJ-SECBINFHSA-N 288.844 3.139 70 20 CGID CCCC1(CNC(=O)CCc2c(C)noc2Cl)CC1 160454725 DVKLVBQSWIDSJF-UHFFFAOYSA-N 284.787 3.266 70 20 CGID CCC[C@H](N[C@@H]1CCc2nc(C)nn2C1)C1CCCCC1 160462617 WEHULPRFAGJZPS-CVEARBPZSA-N 290.455 3.240 70 20 CGID CC(C)CCn1ccc(NC(=O)N(C)CCC2CC2)n1 160527787 RMTNOQYMZJRJES-UHFFFAOYSA-N 278.400 3.193 70 20 CGID C[C@H](C1CC1)N(CCCN1CCCCC1)C1CC1 160578418 CAADLFTYEXUTND-CQSZACIVSA-N 250.430 3.125 70 20 CGID CC(C)CCOC1CCN(CCCN2CCCCC2)CC1 160593729 TZSAGKJTCWHZQL-UHFFFAOYSA-N 296.499 3.390 70 20 CGID CC[C@H](C(=O)NC[C@@H](OC)C(C)(C)C)c1ccc(F)cc1 160642177 LHEZDINOHIIHMF-LSDHHAIUSA-N 295.398 3.497 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccc(F)cc1 160754129 OBLUUUFMAXCBAN-HNNXBMFYSA-N 291.366 3.437 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CCOC(C)C 160815100 UTCBKFBCDHILBO-ZIAGYGMSSA-N 255.402 3.229 70 20 CGID CCN(C)C[C@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160829238 REPUKGUPHWKNPY-CQSZACIVSA-N 280.456 3.003 70 20 CGID C[C@@H]1CCC[C@H](NC(=O)N(CCN(C)C)C2CCCC2)C1 160916652 FIOHJXPGPGGIQJ-CABCVRRESA-N 295.471 3.081 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1csc(COC)n1 160983774 LCCWHLWGYSHOAZ-DGCLKSJQSA-N 296.436 3.330 70 20 CGID CN(C)c1ccc(CNCCc2cccc(Cl)c2)cn1 159605127 FFBVUDKZASOJJR-UHFFFAOYSA-N 289.810 3.133 70 20 CGID COC[C@@H](C)NCc1cc(C(F)(F)F)ccc1Cl 159871390 AUEXADVRKQZKJI-MRVPVSSYSA-N 281.705 3.483 70 20 CGID Cc1ccsc1CCCC(=O)NCCc1ccco1 159689985 KROCKPQAJMNEQW-UHFFFAOYSA-N 277.389 3.331 70 20 CGID Cc1cccc([C@@H](NC(=O)C2CC2)c2ccccn2)c1 159935485 LBARQUSDRYGWRB-MRXNPFEDSA-N 266.344 3.006 70 20 CGID COCC(C)(C)C(=O)Nc1cccc(SC)c1 159576164 JWKMGKNLPGUKNC-UHFFFAOYSA-N 253.367 3.020 70 20 CGID Cc1cc(NC(=O)C2(Cc3ccccc3)CCC2)c[nH]c1=O 159579758 MPUOZJBWQGEINR-UHFFFAOYSA-N 296.370 3.035 70 20 CGID CC(C)c1ccc(C(=O)NCc2ccccc2F)cn1 159771923 QWWFVEKWKIOWNX-UHFFFAOYSA-N 272.323 3.274 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)CSCc1ccncc1 159595907 QZVWOMZLYHQWNQ-ZIAGYGMSSA-N 278.421 3.010 70 20 CGID O=C(NCC1CCCC1)Nc1cc(Cl)ccn1 217579068 XCOGSIVIISIJQR-UHFFFAOYSA-N 253.733 3.047 70 20 CGID CCc1ccc(CNCc2nn(C)c3ccccc23)s1 218108443 ZRXRCDSQJBAGAX-UHFFFAOYSA-N 285.416 3.487 70 20 CGID C[C@@H](NC(=O)C[C@@H]1CCCCC1(C)C)C(=O)NC(C)(C)C 161095690 UNQZIALQKOOLGT-OLZOCXBDSA-N 296.455 3.012 70 20 CGID CCCCn1ncc(Nc2cc(Cl)nc(C)n2)c1C 161113967 CBFXKJNWVXZBQD-UHFFFAOYSA-N 279.775 3.487 70 20 CGID CC[C@H](S[C@@H](CC)c1ccc(F)cc1)C(N)=O 161339248 JYUJCWYGIBBROR-RYUDHWBXSA-N 255.358 3.274 70 20 CGID Cc1ccc(Cl)cc1NC(=O)N[C@H]1CC[C@H](O)CC1 160031927 NBHIYDLVFUBHJP-TXEJJXNPSA-N 282.771 3.073 70 20 CGID O=C(CC[C@@H]1CCOC1)N[C@@H]1CCCc2sccc21 160092071 CFQPPKFXVONPCX-DGCLKSJQSA-N 279.405 3.058 70 20 CGID CSC[C@@H](CCO)N[C@@H](C)c1cccc(Cl)c1 160282507 ZFVYNGHDKQWETE-GXFFZTMASA-N 273.829 3.105 70 20 CGID Clc1cc(N[C@H]2CCO[C@H](C3CC3)C2)ccn1 160299877 SEUJDUXDPQZMOB-RYUDHWBXSA-N 252.745 3.105 70 20 CGID CC1(C)C[C@@H](NCc2cnc(C3CCC3)s2)CCO1 160504258 DXDJIULNVSXHCO-LBPRGKRZSA-N 280.437 3.458 70 20 CGID Cc1ccnc(N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 160533785 FGRKPZDXVAJXHK-CABCVRRESA-N 269.348 3.117 70 20 CGID C[C@H](CO)SCc1ccc(Br)cc1 160755627 VPHMBJSVNPHECU-MRVPVSSYSA-N 261.184 3.063 70 20 CGID CC(C)(C)c1nsc(N2CCCC[C@@H]2c2ncc[nH]2)n1 159844776 VXRCWWLLKMJHSJ-SNVBAGLBSA-N 291.424 3.290 70 20 CGID CCC[C@H]1CN(C(=O)[C@@H](c2ccccc2)C2CC2)CCO1 159461041 QPLLGIDKODOQRE-IRXDYDNUSA-N 287.403 3.208 70 20 CGID Cc1onc(-c2ccncc2)c1C(=O)N1CCCC[C@@H]1C 159462990 WDMCPRWEMFDYDZ-NSHDSACASA-N 285.347 3.060 70 20 CGID Cc1cc(C)cc(-c2cc(NC(=O)[C@H]3CC[C@@H](C)O3)[nH]n2)c1 159696861 SOHUMAZBMLTTCB-IUODEOHRSA-N 299.374 3.200 70 20 CGID CC(C)CONC(=O)Nc1cc(F)ccc1OC(F)F 161002295 QBDJBEHYOGXRMB-UHFFFAOYSA-N 292.257 3.136 70 20 CGID CC[C@H](S[C@H]1CCN(C)C1=O)c1ccc(F)cc1 161354552 WBFGJGNPSAWPAS-STQMWFEESA-N 267.369 3.241 70 20 CGID CCC1(CNC(=O)C[C@@H](C)c2ccncc2)CCC1 161422468 JGRQUEZJQZBWNU-CYBMUJFWSA-N 260.381 3.272 70 20 CGID CCC[C@@H](C(=O)Nc1ccn(CC(F)F)n1)C(C)C 160153388 FYKGRXQWAZHJQD-SNVBAGLBSA-N 273.327 3.159 70 20 CGID Clc1cc(N2CCc3cnccc32)nc(C2CC2)n1 160370828 CWIXWGJKRGFBAK-UHFFFAOYSA-N 272.739 3.097 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2NC(=O)NC1CCCCC1 159439163 JILYHJQMYLWWHS-MRXNPFEDSA-N 287.407 3.278 70 20 CGID CCCCn1ncc(C(=O)N2CCc3ccccc32)c1C 159442473 AFDUROODMALOSR-UHFFFAOYSA-N 283.375 3.195 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc2c(c1)CCC2 159840371 TZQPUDFYFPFQJK-QGZVFWFLSA-N 299.414 3.397 70 20 CGID C[C@@H]1CCC[C@H](C(=O)N(C)Cc2nccn2C(F)F)C1 159900495 AAUIHGAAJWWHNH-MNOVXSKESA-N 285.338 3.063 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1cc(C)cc(C)c1 159927522 SNKATTSENGLYTQ-UHFFFAOYSA-N 278.396 3.224 70 20 CGID Cc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCCSC1 159535102 FTBGFDKLEPDRFT-KGLIPLIRSA-N 292.448 3.197 70 20 CGID COC[C@@H](NC(=O)c1ccc(Cl)cc1C)C(C)C 159579654 VRWMDXYYJXJRFS-CYBMUJFWSA-N 269.772 3.049 70 20 CGID Cc1cccc(C)c1CNC[C@@H](c1ccco1)N(C)C 160411562 MEFLXBBDWDEDBZ-INIZCTEOSA-N 272.392 3.289 70 20 CGID Cc1ccccc1OCCCNC(=O)N1CCCC[C@H]1C 217300383 KELYKQRNNMSXNB-OAHLLOKOSA-N 290.407 3.348 70 20 CGID CCc1ccc(/C=C/C(=O)N2C[C@H]3CCC[C@@H]3C2)o1 161003488 XGTOYLLOPXLQOI-RYYBZQDPSA-N 259.349 3.114 70 20 CGID CCNCC1CCN(C(=O)C[C@H]2CCC[C@H](C)C2)CC1 161088588 UDJCHVAVHMXIDB-HOCLYGCPSA-N 280.456 3.051 70 20 CGID CCCC(O)(CCC)CC(=O)N1CCC[C@@H]1C1CCC1 161363971 JSIXVQUEHDIMGR-OAHLLOKOSA-N 281.440 3.499 70 20 CGID CSC[C@@H](C)C(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C 161485240 YGRAQPRJKPNMHA-MRVPVSSYSA-N 293.392 3.224 70 20 CGID CC[C@H](NC(=O)c1n[nH]c2ccccc12)c1c(C)noc1C 160283683 JPCNGSUGEPTGFC-LBPRGKRZSA-N 298.346 3.049 70 20 CGID C[C@H](c1nc(C2CC2)no1)c1c(F)cccc1F 160819673 FZXRRKCYSUQKKX-ZETCQYMHSA-N 250.248 3.377 70 20 CGID CC[C@@H](NC[C@H](C)N1CCc2ccccc2C1)C1CC1 159833882 IDAVENHFCABAKH-KBXCAEBGSA-N 272.436 3.211 70 20 CGID CCCCCOCC(=O)N(C)c1ccc(OC)c(F)c1 159443025 RKZUAYSYUDZTGJ-UHFFFAOYSA-N 283.343 3.004 70 20 CGID COc1ccc(C)nc1NC(=O)c1ccc(C(C)C)nc1 159870594 DGEMUXHEUOAPTJ-UHFFFAOYSA-N 285.347 3.169 70 20 CGID C[C@@H]1C[C@H]1c1cc(NC(=O)c2ccn(C3CCCC3)n2)[nH]n1 159681777 CJARMIJZYVGOFT-ZYHUDNBSSA-N 299.378 3.097 70 20 CGID CCS(=O)(=O)c1ccc([C@H](C)N[C@H](C)CC2CC2)cc1 159503624 VCYQTRXNBNGRJE-OLZOCXBDSA-N 295.448 3.319 70 20 CGID C[C@H]1CN(C(=O)Nc2cccc3ccccc23)CC[C@@H]1O 159365996 PDTYYWOBPKUNDF-LRDDRELGSA-N 284.359 3.074 70 20 CGID Cc1ccc(C(=O)CCN2CCC(n3cccn3)CC2)cc1 159573909 BZQVMKMNEIMKKZ-UHFFFAOYSA-N 297.402 3.101 70 20 CGID CN(Cc1ccccc1C(F)(F)F)C[C@@H]1CCC[C@@H]1O 159751607 YABIXSGNFMXBEU-JSGCOSHPSA-N 287.325 3.298 70 20 CGID CCO[C@@H]1C[C@@H](N[C@H](C)c2ccncc2)C12CCC2 160969738 PUKWAYDXSVUILL-BPLDGKMQSA-N 260.381 3.080 70 20 CGID CCOc1ccccc1[C@H](C)N[C@H]1CCN2CCCC[C@@H]12 217659495 VFEWUDXRCXHVIO-XIRDDKMYSA-N 288.435 3.363 70 20 CGID CCc1ccc(C(C)(C)C(=O)NC2CC=CC2)cc1 161003334 OWRCEWFNENSIRX-UHFFFAOYSA-N 257.377 3.361 70 20 CGID CS[C@H](C)CC(=O)NCc1cccc(OCC(C)C)c1 161024797 IETACTIZAZPJOM-CYBMUJFWSA-N 295.448 3.479 70 20 CGID CC(C)[C@H](CNC(=O)[C@H]1CCCCO1)c1ccccc1 161429441 AOSXWAQHAPDRPX-JKSUJKDBSA-N 275.392 3.112 70 20 CGID C[C@@H](NC(=O)Nc1nnc(C(C)(C)C)s1)C1CCC1 161477123 JJWBTYQZNUELKX-MRVPVSSYSA-N 282.413 3.146 70 20 CGID C[C@H](OC1CCCCCC1)C(=O)NCC1(C2CC2)CC1 160090984 RPGIMKUVYLNJST-ZDUSSCGKSA-N 279.424 3.421 70 20 CGID CC(C)OCCCCNc1nc(C(C)(C)C)ns1 160315308 YJFJWUXVFXEGBN-UHFFFAOYSA-N 271.430 3.453 70 20 CGID CS[C@H](C)CNC(=O)Nc1ccc(Cl)c(F)c1 160615400 XSSYLFVPGOYYAF-SSDOTTSWSA-N 276.764 3.352 70 20 CGID CC1(NC(=O)NCCc2nc(C(C)(C)C)cs2)CCC1 160843991 YCOXNLFUSUQFTH-UHFFFAOYSA-N 295.452 3.225 70 20 CGID C[C@H](C(=O)Nc1nccs1)c1c(F)cccc1F 160960651 XUMQYKFKXQANCK-ZETCQYMHSA-N 268.288 3.164 70 20 CGID C[C@H]1CCCN(CC2CCN(C(=O)C(C)(C)C)CC2)[C@@H]1C 159805280 MEALMHGEGHETOD-LSDHHAIUSA-N 294.483 3.392 70 20 CGID CCCCn1ncc(NC(=O)NC(C2CC2)C2CC2)c1C 159715788 KKQHAPKEOFHNKW-UHFFFAOYSA-N 290.411 3.302 70 20 CGID CCCCn1ncc(NC(=O)N2CCCC[C@@H]2C)c1C 159725170 CNSODKSXVBRTGS-LBPRGKRZSA-N 278.400 3.398 70 20 CGID CC1(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1 159735836 QSHXSHWVGIPFSZ-UHFFFAOYSA-N 286.419 3.089 70 20 CGID Cc1cnc(C(=O)N2C[C@@H](C)CSc3ccccc32)cn1 159558306 UGMYUWHTCCKCTK-LLVKDONJSA-N 299.399 3.174 70 20 CGID COCCOCCCCNc1nccc2ccccc12 159398093 VYIQMZWDVASMJE-UHFFFAOYSA-N 274.364 3.090 70 20 CGID CN(C)[C@@H]1CCC[C@@H](Nc2nc(C(C)(C)C)ns2)C1 159842228 LHCVIWDVQPDUCX-GHMZBOCLSA-N 282.457 3.120 70 20 CGID C1=C[C@H]2C[C@H]1C[C@@H]2CN[C@@H]1CCN(Cc2ccccc2)C1 218731835 WZCWSUNIUQUHJZ-INDMIFKZSA-N 282.431 3.063 70 20 CGID C[C@H](Cc1ccco1)NCc1cccc2cc[nH]c12 218090540 YDMRZBMAZZRFAG-GFCCVEGCSA-N 254.333 3.482 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)NC[C@@H]2Cc3ccccc32)C1 161051824 PVXADADOWZVOON-YUELXQCFSA-N 257.377 3.269 70 20 CGID CC[C@H](NC[C@@H](C)COCc1ccccc1)[C@@H]1CCOC1 161308166 SCQPJLNVFGDLST-NXHRZFHOSA-N 291.435 3.244 70 20 CGID CCCN(C(=O)C1CCC1)[C@H](C)C(=O)Nc1ccccc1 161440542 WRZQPHRKCMYVFN-CYBMUJFWSA-N 288.391 3.052 70 20 CGID Cc1cc(Cl)ccc1C(=O)NC[C@H](O)C1CCCCC1 160240150 BYVIJHVJYHEZPT-HNNXBMFYSA-N 295.810 3.319 70 20 CGID C[C@H](OC1CCCCCC1)C(=O)Nc1cccc(F)n1 160622539 MHXUVUOSAPVVLV-NSHDSACASA-N 280.343 3.287 70 20 CGID C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C)[C@@H](C)C1 160873872 AGRZORREFNATIS-RDBSUJKOSA-N 290.407 3.011 70 20 CGID CCc1nc([C@@H](C)N[C@@H](C)C(=O)OC(C)(C)C)cs1 160904671 UYTMUVYQTZEFSN-ZJUUUORDSA-N 284.425 3.086 70 20 CGID Cc1ccc(C(=O)N[C@@H](C)CC(=O)c2cccs2)o1 160914802 WEVXZKGWKNQUAQ-VIFPVBQESA-N 277.345 3.041 70 20 CGID O=C(CCc1cccnc1)N[C@H]1CCCc2sccc21 159827916 MCFNEQAXOLONHS-AWEZNQCLSA-N 286.400 3.270 70 20 CGID CC(C)[C@H]1CCN(C(=O)C[C@@H]2CNc3ccccc32)C1 159593058 NVGDTYKSYIJOFD-UONOGXRCSA-N 272.392 3.090 70 20 CGID Cc1ccc(OS(=O)(=O)Cc2ccc(F)cc2)cc1C 218266650 IDFAHUCYHIMFND-UHFFFAOYSA-N 294.347 3.351 70 20 CGID CC[C@H](C)N(C)CCNc1nc2ccccc2s1 217366004 YVOGEXMUXZHCHU-NSHDSACASA-N 263.410 3.439 70 20 CGID COc1cc(CN2CC[C@@H](C)C[C@@H]2C)cc(OC)c1O 217843230 SOYNPRXTWNNQBS-NEPJUHHUSA-N 279.380 3.030 70 20 CGID O=C1C[C@@H]2CC[C@H](C1)N2CCc1cccc(Cl)c1 217814002 DEYSMTSIXHJDPG-OKILXGFUSA-N 263.768 3.078 70 20 CGID COC[C@@H](NC(=O)Nc1cc(C)ccc1Cl)C1CC1 161057861 SVMJTZRGUDOTOG-CYBMUJFWSA-N 282.771 3.195 70 20 CGID CCO[C@@H]1CCCN(C(=O)C(C)(C)C2CCCC2)C1 161099490 GGIXAOBTDQMTRH-CQSZACIVSA-N 267.413 3.230 70 20 CGID CC[C@H](NCCOc1cc(C)cc(C)c1)c1cnn(C)c1 161239740 XQLIEQHRSMJVQV-KRWDZBQOSA-N 287.407 3.157 70 20 CGID CC(C)Oc1ccc(CN[C@@H](C)c2cncs2)cn1 160054425 JMCPDTFFBKQSOU-NSHDSACASA-N 277.393 3.176 70 20 CGID CO[C@]1(CN[C@H]2CCC(C)(C)c3ccccc32)CCOC1 160101806 NWOBYKQKTQAEMM-WMZOPIPTSA-N 289.419 3.194 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 160518341 JZMWDUPDEIWPHT-PBHICJAKSA-N 286.375 3.410 70 20 CGID C[C@@H](CCc1ccccc1F)NC[C@H]1CCCC[C@@H]1O 160546886 KXEKXHDTAASVAB-LXZKKBNFSA-N 279.399 3.288 70 20 CGID Cc1ccc([S@](=O)Cc2nccs2)cc1C 160631226 KRRMQOVRVTURKE-INIZCTEOSA-N 251.376 3.068 70 20 CGID CC(C)c1cc(-c2nc(-c3ccc4c(c3)CCO4)no2)no1 160901631 VMJXBCUMFZVAPZ-UHFFFAOYSA-N 297.314 3.450 70 20 CGID C[C@@H](CCn1cccn1)Nc1ccc2c(c1)OC(C)(C)O2 159413181 VKMFHDUXOZDCBV-LBPRGKRZSA-N 287.363 3.281 70 20 CGID CS[C@@H](C)CC(=O)NCC1(c2ccc(F)cc2)CC1 159951462 RNFORBYPZIHMJK-NSHDSACASA-N 281.396 3.115 70 20 CGID COc1cc(CN[C@H](C)c2ccsc2)cc2c1OCO2 159900948 JEVDFJNVBWSXNB-SNVBAGLBSA-N 291.372 3.336 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cccs1 161033738 VMQUIDDPJVRNQL-AVGNSLFASA-N 252.427 3.272 70 20 CGID COc1ccccc1[C@H]1CCCN1CCOCC1CC1 160421675 MHHXCQNZUJXMPH-MRXNPFEDSA-N 275.392 3.259 70 20 CGID CCc1ccc([C@H](C)CC(=O)N[C@H]2CCC[C@H](N)C2)cc1 161244883 KBKBTMAJQGNAIQ-COXVUDFISA-N 288.435 3.129 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)c3ccoc3C)c2C)o1 161361384 BZIGDTZAGLIJHP-UHFFFAOYSA-N 285.303 3.440 70 20 CGID CC(C)C1CCC(NC(=O)NC2C[C@H](C)O[C@@H](C)C2)CC1 160053089 NPHQHMBDRQGUFT-HESLUPGFSA-N 296.455 3.456 70 20 CGID C[C@H](C(=O)O[C@H](c1ccccn1)C(F)(F)F)C1CC1 160250517 DIRBVVQZQWEEEY-GZMMTYOYSA-N 273.254 3.274 70 20 CGID CCN1CC[C@H](NCCOc2cccc(Cl)c2)[C@H](C)C1 160252535 KCXKDCUPXHLDGW-CJNGLKHVSA-N 296.842 3.039 70 20 CGID CCN(C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1)C1CCCCC1 160428115 LHNKRBQOHGUICH-GDBMZVCRSA-N 294.439 3.308 70 20 CGID CCCNC(=O)c1cccc(CN[C@@H](C)[C@H](C)CC)c1 160566321 QRCVWGDZMUVWEN-KGLIPLIRSA-N 276.424 3.351 70 20 CGID CN(CCC1CC1)C(=O)c1cc(F)cc2cccnc12 159384008 UKCAXLXEKGBUSV-UHFFFAOYSA-N 272.323 3.246 70 20 CGID Clc1ccc([C@@H]2CN(CCOCC3CC3)CCO2)cc1 159424251 ARBKLVZTFQXBFB-INIZCTEOSA-N 295.810 3.140 70 20 CGID COc1cc(NC(=O)c2cc(C)nc(Cl)c2)ccc1F 160238420 RQPQADMPYGZMOX-UHFFFAOYSA-N 294.713 3.443 70 20 CGID Cc1ccccc1NC(=O)NC[C@H](C)c1nccs1 160373911 QFFVLRPQZQKDCR-NSHDSACASA-N 275.377 3.377 70 20 CGID CC(C)[C@@H](C)N(C)C[C@@H](O)c1cc2ccccc2o1 216933228 FSBVGTICQUBAQH-TZMCWYRMSA-N 261.365 3.443 70 20 CGID COCC(C)(C)C(=O)Nc1cc(C(C)C)c(O)cc1C 161090026 SDSLSZJDQGUERC-UHFFFAOYSA-N 279.380 3.435 70 20 CGID CCn1c(SCc2ccnn2C)nc2ccccc21 161168735 BEQFMGKEXSSAJN-UHFFFAOYSA-N 272.377 3.082 70 20 CGID Cc1cc(CSCCC(=O)N(C)c2ccccc2)no1 160091409 RKSPYDFHTYIKHE-UHFFFAOYSA-N 290.388 3.269 70 20 CGID CC(C)c1ccc(OCCN[C@H](C)[C@H]2CCOC2)cc1 160329387 XFUDZILLZUGMGG-ZBFHGGJFSA-N 277.408 3.203 70 20 CGID CCCCSCCC(=O)N[C@@H]1COc2ccccc2C1 159854839 UQJIRWXXNXTUHL-AWEZNQCLSA-N 293.432 3.030 70 20 CGID CCCn1nccc1CNc1ccc(C(F)(F)F)nc1 160192645 XPOUQKLPBSTLGL-UHFFFAOYSA-N 284.285 3.319 70 20 CGID Fc1cc(Cl)cc(CN[C@@H]2CCN3CCCC[C@H]23)c1 160854596 ARXZNLDXHZWMDA-HUUCEWRRSA-N 282.790 3.196 70 20 CGID NCC1(NC(=O)c2cc3ccc(F)cc3s2)CCCC1 161204734 NUOWGZCNGHAWPH-UHFFFAOYSA-N 292.379 3.042 70 20 CGID CCCn1c(C)nnc1COc1cc(C)ccc1F 161383401 QXFFVVHNCNNJIG-UHFFFAOYSA-N 263.316 3.023 70 20 CGID CCc1nc(C(=O)N[C@H]2CCCc3sccc32)co1 160485026 WDLAYYXBNVOAQT-JTQLQIEISA-N 276.361 3.106 70 20 CGID CCCCNc1ccccc1C(=O)N1C[C@@H](C)O[C@H](C)C1 160489284 AKUJGRXDOAQTTR-ZIAGYGMSSA-N 290.407 3.148 70 20 CGID CC(C)(C(=O)Nc1ccccc1O)c1cccc(F)c1 160529212 CWUTZYMEHHDQGQ-UHFFFAOYSA-N 273.307 3.448 70 20 CGID CCN(C(=O)c1cncc(-c2ccc(OC)cc2)c1)C1CC1 160937273 BJINJSYRUUYMTC-UHFFFAOYSA-N 296.370 3.382 70 20 CGID C[C@@H]1CN(C[C@@H]2CCCN2CCC2CCCC2)C[C@@H](C)O1 159637739 FKKDDIHVPQFLIU-NUJGCVRESA-N 294.483 3.140 70 20 CGID CN(C)C(=O)c1cccc(CSc2ccncc2)c1 159877053 OZJHJDZMNGKSGI-UHFFFAOYSA-N 272.373 3.076 70 20 CGID Cc1cccc(COc2ccc([C@@H](C)NCCO)cc2)c1 159721464 MAUXSYIYALTDIO-OAHLLOKOSA-N 285.387 3.217 70 20 CGID CC[C@H](C(=O)NCCCCCOC)c1ccc(F)cc1 159530884 DBBANDQTVUIKLM-HNNXBMFYSA-N 281.371 3.252 70 20 CGID Cc1ccccc1C[C@H](C)NC(=O)NC1(C)CCC1 159547982 CPAZOPXBFPGFHA-ZDUSSCGKSA-N 260.381 3.168 70 20 CGID CN(C(=O)[C@H](c1ccccc1)C1CC1)c1ccccn1 159966940 WLHXYRJYDYORNH-MRXNPFEDSA-N 266.344 3.238 70 20 CGID CSc1cccc(NC(=O)C2=C(C)OCCC2)c1 159575055 SLTQZABOXRLNCZ-UHFFFAOYSA-N 263.362 3.431 70 20 CGID O=C(C1=CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 159992148 OSCAMSKSOKEDIF-OAHLLOKOSA-N 299.370 3.232 70 20 CGID CCCn1nccc1CNc1ccc(C(=O)OCC)cc1 159997594 WFRCSZGYPAQFBY-UHFFFAOYSA-N 287.363 3.082 70 20 CGID CCOc1cccc(CN[C@H](C)c2cncc(F)c2)c1 159407371 NEJCKRFVXSRJMQ-GFCCVEGCSA-N 274.339 3.470 70 20 CGID Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1F 159542778 LPEOROLKYCDQGR-BMFZPTHFSA-N 275.367 3.181 70 20 CGID C[C@@H](CNc1nc(C(C)(C)C)ns1)CC1(C)OCCO1 159594175 VOODBTGYWJNLGP-SNVBAGLBSA-N 299.440 3.037 70 20 CGID C1CCN(CCCN2CCC[C@@H]3CCC[C@@H]32)CC1 161377931 LPUOVRWECJGQHX-HOTGVXAUSA-N 250.430 3.127 70 20 CGID CS[C@@H]1CCCC[C@H]1Nc1ncnc2c1CCCC2 217807113 SFGOAWIRKYSBBI-ZIAGYGMSSA-N 277.437 3.442 70 20 CGID Cc1ccc(C(=O)NC[C@H](C)Oc2ccccc2C)cc1N 161171677 URVGAPKHFBGVOO-AWEZNQCLSA-N 298.386 3.083 70 20 CGID CCC(CC)(CN)C(=O)NCC1(CC(C)C)CCC1 161230745 DXEQAVXUQGQKRW-UHFFFAOYSA-N 268.445 3.084 70 20 CGID COc1ccccc1CCC(=O)N1[C@@H](C)CC[C@@H]1C 161426704 GLPBMQAUIHOESN-STQMWFEESA-N 261.365 3.027 70 20 CGID CCCOc1ccc(NC(=O)N[C@]2(C)CCOC2)c(C)c1 161481839 BRKIXKQXJLJZLJ-MRXNPFEDSA-N 292.379 3.084 70 20 CGID Cc1ccc([C@@H](C)NCc2cn3c(C)cccc3n2)o1 160341676 RDGJDQBMKGJFGB-CYBMUJFWSA-N 269.348 3.395 70 20 CGID Fc1ccc2oc(N[C@H]3CCO[C@@H](C4CC4)C3)nc2c1 160352440 GSOIJZOVECRSMN-SMDDNHRTSA-N 276.311 3.336 70 20 CGID Cc1nc2ccccc2nc1N[C@@H]1CCO[C@@H](C2CC2)C1 160405004 WKUWZLIWKORIDV-CZUORRHYSA-N 283.375 3.308 70 20 CGID Cc1cnc(N[C@H]2CCO[C@H](c3ccccc3)C2)nc1C 160615653 UBUHNBUQMNWYGI-HOTGVXAUSA-N 283.375 3.426 70 20 CGID CCCCn1ncc(C(=O)N(CCC)CC2CC2)c1C 160680300 ZXFRJGQLMBTKFD-UHFFFAOYSA-N 277.412 3.254 70 20 CGID CCC(CC)NC(=O)[C@H](C)N[C@@H](C)c1cccc(F)c1F 159424725 SRMHIJJZWCQBOE-QWRGUYRKSA-N 298.377 3.309 70 20 CGID CC(C)Cc1ccc(CCCC(=O)N[C@H](C)CCO)cc1 159710254 FKPYALSWJSGNKG-OAHLLOKOSA-N 291.435 3.095 70 20 CGID Cc1cccc(C(=O)Nc2ccnn2CC(C)C)c1F 159597849 DKHQFEPUOVIUBF-UHFFFAOYSA-N 275.327 3.239 70 20 CGID C[C@@H](NC1CC(C)(C)NC(C)(C)C1)c1cncc(F)c1 159627456 WXNHQOLYQLRYFR-LLVKDONJSA-N 279.403 3.181 70 20 CGID Cc1ccc(NC(=O)N(C)[C@@H]2CCC[C@H](C)C2)cn1 161504434 CTUKEIUWYGRTDX-SMDDNHRTSA-N 261.369 3.432 70 20 CGID CCCn1nccc1CNc1ccc(-n2cccn2)cc1 160027152 CCKAPZAXIUPFSZ-UHFFFAOYSA-N 281.363 3.091 70 20 CGID CCCCNc1ccccc1C(=O)NC[C@@H](O)[C@@H](C)CC 160039575 NBQXPFPSFSGGBZ-XJKSGUPXSA-N 292.423 3.035 70 20 CGID CCc1c(Cl)nc(C)nc1N[C@@H]1CCO[C@H](C2CC2)C1 160384152 BCZUARCUSNCIBQ-YPMHNXCESA-N 295.814 3.370 70 20 CGID CN(Cc1ccccn1)C(=O)C(C)(C)C1CCCC1 160417878 JQJITCOQGXEPJM-UHFFFAOYSA-N 260.381 3.256 70 20 CGID CCCc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1 160422156 HLWCDFBZXVHGLH-GUYCJALGSA-N 298.434 3.205 70 20 CGID CC[C@H](C)OCC(=O)N[C@@H](C)c1c(F)cccc1Cl 160441864 XWNWBCBSIYOAGU-UWVGGRQHSA-N 287.762 3.471 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@@H]1CCCOc2ccc(F)cc21 160495342 YVSVQXVSIQVRRO-WQVCFCJDSA-N 293.382 3.180 70 20 CGID O=C(C[C@@H]1C=CCC1)Nc1cccc(OCCF)c1 160574662 OVNMIIPPLHNNKP-GFCCVEGCSA-N 263.312 3.330 70 20 CGID CC(C)c1ccc(C(=O)Nc2cccc3cn[nH]c23)cn1 160660969 ONYAEXGORYIUGF-UHFFFAOYSA-N 280.331 3.334 70 20 CGID Cc1ncccc1C(=O)N1CC(C)(C)Oc2ccccc21 160809216 CLRIALNDPCRBTI-UHFFFAOYSA-N 282.343 3.208 70 20 CGID C[C@@H](c1ccccc1)[C@@H](C)NC(=O)c1ccc(CN)cc1 160891660 DOSNZMNVYZZPQH-ZIAGYGMSSA-N 282.387 3.067 70 20 CGID CC[C@@H](C)[C@](C)(O)CNc1nc(C(C)(C)C)ns1 159448517 FWRHLKUFFAPXJN-NOZJJQNGSA-N 271.430 3.045 70 20 CGID Cc1cc(N[C@@H]2CCCc3cc(N)ccc32)nc(C)n1 159477254 MPWSQRRHBCNHOO-OAHLLOKOSA-N 268.364 3.165 70 20 CGID Cc1ccc(C)c(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159562198 JZALNQYAUUNECA-ZACQAIPSSA-N 271.404 3.351 70 20 CGID O=C(CCCC1CCCCC1)NCC1(CO)CCCC1 160327385 YUNGCUZZMGAZPL-UHFFFAOYSA-N 281.440 3.406 70 20 CGID O[C@@H](Cc1ccccc1)CN1CCC[C@@H]1Cc1ccccc1 218775070 GJUHIQSCYZDPEW-UXHICEINSA-N 295.426 3.297 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2OC)c(OC)c1 218041017 WRIQNYNKHARKAM-APHBMKBZSA-N 293.407 3.312 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2nnsc2Cl)n1 160215305 QJDZMWQYVKTKAW-LBPRGKRZSA-N 294.811 3.232 70 20 CGID Cc1cc(C(=O)Nc2ccccc2N2CCCCC2)ncn1 161186949 ZPUGSSNVNMBOKT-UHFFFAOYSA-N 296.374 3.028 70 20 CGID CC1(NC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)CCC1 161316903 RKINOWYQBVCJJP-JOYOIKCWSA-N 280.318 3.063 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@H]1CCCS1 160152843 RHXPZMVNWRENJJ-ZYHUDNBSSA-N 267.419 3.137 70 20 CGID CCN1CCC(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1 160336632 WUKAHNKROUSABG-ARFHVFGLSA-N 292.467 3.193 70 20 CGID CC[C@@H](C)CS(=O)(=O)N(C)c1cccc(SC)c1 160437940 UDCIZKPHSNARMG-LLVKDONJSA-N 287.450 3.221 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@H](Cc1ccccc1)C1CC1 160464320 RALDWDOTXLBUNP-KURKYZTESA-N 273.420 3.148 70 20 CGID Clc1cc(N[C@H]2CCO[C@@H](C3CC3)C2)nc(C2CC2)n1 160474360 LAXUWAXXWYUWAX-NWDGAFQWSA-N 293.798 3.377 70 20 CGID CC[C@@H](C)CN(CC)CC(=O)c1[nH]c(C)c(C(C)=O)c1C 160590811 ZCSNYNJPVMQBMQ-LLVKDONJSA-N 292.423 3.385 70 20 CGID Cc1cc(N[C@@H](C)c2c(F)cccc2F)nn1C 159668300 QWUNBYVHESGROX-VIFPVBQESA-N 251.280 3.180 70 20 CGID COc1cc(C(=O)N[C@@H](C)c2cccc(O)c2)ccc1F 159699292 IIHZOGNAXUYJBR-JTQLQIEISA-N 289.306 3.031 70 20 CGID COCCOc1ccc([C@@H](C)N[C@H]2CCCSC2)cc1 159555495 XZZDYNYAHSJPIO-HIFRSBDPSA-N 295.448 3.258 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1nnc(C(C)(C)C)s1 161439993 YTVGVCAUIAJXOS-VIFPVBQESA-N 271.430 3.045 70 20 CGID C[C@@H]1C[C@H](N[C@@H]2CCCSC2)CN1Cc1ccccc1 159548657 JIOMBDOBIXAZEI-OIISXLGYSA-N 290.476 3.135 70 20 CGID C[C@@H]1Cc2ccccc2N(C[C@@H](O)c2ccccc2)C1 217543876 VJIOWUNUWKSVIO-RDTXWAMCSA-N 267.372 3.419 70 20 CGID Cc1cccc(C)c1NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 161064355 PDGOYQYFGGCAJW-CABCVRRESA-N 288.391 3.383 70 20 CGID CC[C@H](C)CS[C@@H]1CCCN(CC(F)(F)F)C1=O 160045615 CPQCAUVGWLZRQZ-VHSXEESVSA-N 283.359 3.319 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@@H]1CC=CCC1 160497127 FZWVOAABOMPOHU-HUUCEWRRSA-N 277.408 3.341 70 20 CGID CCCC[C@@H]1CCC[C@@H]1NC(=O)N(C)C[C@@H]1CCC[C@@H]1O 160654544 QMJXJTCOPJWTGA-UGUYLWEFSA-N 296.455 3.148 70 20 CGID C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1nncn1C 160759199 YRIPUTMONBWVEB-SECBINFHSA-N 299.205 3.315 70 20 CGID CN(Cc1cccn1C)C(=O)c1cccc(F)c1Cl 160912870 VHCQUBZMIPMEDJ-UHFFFAOYSA-N 280.730 3.090 70 20 CGID COc1cccc(CNC(=O)c2cccn2C(C)C)c1 160930381 ZQTNPVZVSUFOLW-UHFFFAOYSA-N 272.348 3.008 70 20 CGID Cn1cnnc1CSc1cc(Cl)ccc1Cl 160979886 WXLNAWJUPSXLKZ-UHFFFAOYSA-N 274.176 3.414 70 20 CGID Cc1cc(C)c(C(=O)NCCOc2ccccc2Cl)o1 159414119 RFBVFSWTFVDPHU-UHFFFAOYSA-N 293.750 3.359 70 20 CGID C[C@@H](SCCN1CCOCC1)c1ccc(F)cc1F 159943805 MLBGODKWJJGJJN-LLVKDONJSA-N 287.375 3.091 70 20 CGID C[C@H](c1ccc(F)cc1F)N(C)CCOCC1CC1 159764665 QGDJORUCQICJFE-LLVKDONJSA-N 269.335 3.384 70 20 CGID Cc1ccc(C)c([C@H](C)N(C)C(=O)CCNC(C)C)c1 161307377 ULCHECRWQWZFMF-HNNXBMFYSA-N 276.424 3.211 70 20 CGID COCCC1(CNC(=O)N2CCCC(C)(C)CC2)CC1 161015619 UDHKHVMGANFQSY-UHFFFAOYSA-N 282.428 3.025 70 20 CGID O=C(CC1CCNCC1)N(CC1CCC1)c1ccccc1 161438106 SCPFDIIVSZIURQ-UHFFFAOYSA-N 286.419 3.209 70 20 CGID Cc1cccc([C@H](NC(=O)C(F)(F)F)c2ccccn2)c1 160017466 WQZJQXZUCSCEJT-ZDUSSCGKSA-N 294.276 3.158 70 20 CGID CC(C)OCCC(=O)N[C@@H]1CCCc2sccc21 160106962 NVTGTMQFKCQKEL-GFCCVEGCSA-N 267.394 3.057 70 20 CGID O=C([C@@H]1CCCCO1)N1CCC[C@H]1c1ccc(F)cc1 160622264 LHFCZRLRQIVOEP-GJZGRUSLSA-N 277.339 3.058 70 20 CGID Cc1cc(F)cc(S(=O)(=O)Nc2c(C)cccc2F)c1 160830021 BHPNKYLDEZOICQ-UHFFFAOYSA-N 297.326 3.382 70 20 CGID CCS[C@H]1CCC[C@H](N[C@@H](C)c2cnn(C)c2)C1 159407941 PWVKXXAVUWFKHC-UBHSHLNASA-N 267.442 3.135 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(CCOC)Cc1ccccc1 159474991 IFRLTPHDHVIXBS-DOTOQJQBSA-N 275.392 3.098 70 20 CGID CCOC(=O)Nc1cccc(OC(=O)C2=CCCC2)c1 159796993 YBTMQYVATOPANU-UHFFFAOYSA-N 275.304 3.271 70 20 CGID CC(C)CC1(C(=O)NCC2(CO)CCCC2)CCCC1 160271944 ICHYEXDEEGSVBL-UHFFFAOYSA-N 281.440 3.262 70 20 CGID CC(C)NCCC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F 161043269 FCMYFEHSUUOOIN-XJKSGUPXSA-N 292.398 3.123 70 20 CGID CC[C@H](S[C@@H](C)C(=O)N(C)C)c1ccc(F)cc1 161355290 WUWAAHYNALNLRY-GWCFXTLKSA-N 269.385 3.487 70 20 CGID CCc1ccccc1C(=O)NCC(C)(C)N1CCCCC1 161378894 UBCQFVRFLDAYNM-UHFFFAOYSA-N 288.435 3.243 70 20 CGID Cc1cc(C(=O)Nc2ccc3c(c2)OCO3)cc(C)c1F 160415242 CUCKOBUBQQYZHE-UHFFFAOYSA-N 287.290 3.424 70 20 CGID CCc1nc(Cl)c(C)c(N[C@H]2CCO[C@H](C3CC3)C2)n1 160469352 WOQUYEQEKJYTSA-RYUDHWBXSA-N 295.814 3.370 70 20 CGID Cc1cnc(C[S@](=O)c2ncc(C(C)(C)C)s2)o1 160548428 CSEQLGNQWWVNLF-GOSISDBHSA-N 284.406 3.045 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](C)c2ccco2)c1 160628787 UDIBBVNYYLOVEZ-CYBMUJFWSA-N 286.375 3.270 70 20 CGID Cc1ccc([C@@H](C)N(C)CCCS(=O)(=O)C(C)C)cc1 160870825 BQIITGYLEMCLOJ-OAHLLOKOSA-N 297.464 3.201 70 20 CGID O=C(CCCC1CCCCC1)N1C[C@@H]2CCC[C@H](C1)N2 160737069 FLPIBJSQFWBOQW-IYBDPMFKSA-N 278.440 3.090 70 20 CGID CCCc1sc(C(=O)N[C@@H]2CCC[C@H](N)C2)cc1CC 161144902 KEXNEZSAUUMOTL-QWHCGFSZSA-N 294.464 3.263 70 20 CGID Cc1ccc(OCCCNC(=O)N2CCCCCC2)cc1 217297857 OIQYEFZZXOWQJI-UHFFFAOYSA-N 290.407 3.350 70 20 CGID c1ccc2sc(N[C@@H]3CCN4CCCC[C@@H]34)nc2c1 217361321 SYTHGFNAZHNRLW-YPMHNXCESA-N 273.405 3.335 70 20 CGID CCN(Cc1ccccn1)[C@@H](C)C(=O)Nc1cccc(C)c1 161120887 JKRDSVAWJNUEBS-HNNXBMFYSA-N 297.402 3.239 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)[C@@H]1CCCS1 161140926 USDXPETZPONKKF-UPJWGTAASA-N 255.427 3.309 70 20 CGID Cc1cnc([C@H](C)NC(=O)C[C@H](C)c2ccncc2)s1 161287897 GOMLFVJYQGSVGD-JQWIXIFHSA-N 289.404 3.218 70 20 CGID CC1(C)CCC(C(=O)N2CCCC[C@@H]2c2ncon2)CC1 161407340 DOWQDFZPQXUVHL-CYBMUJFWSA-N 291.395 3.340 70 20 CGID CC[C@@H](NCCSc1ccccc1)c1cnn(C)c1 160511814 IBISPDNUGMEAAP-OAHLLOKOSA-N 275.421 3.253 70 20 CGID C[C@H]1C[C@H](NCCOc2cccc3ccccc23)CCN1C 160811345 HWCOVEHGGDJEHN-DOTOQJQBSA-N 298.430 3.291 70 20 CGID Cc1cccc(N(C)C(=O)c2ccc(F)c(Cl)c2)n1 160975860 JNHXFCWHZPVEDD-UHFFFAOYSA-N 278.714 3.459 70 20 CGID CCC(CC)(CC)NC(=O)c1ccnn1C(C)C 159776892 NXNJTMYDTJKFDP-UHFFFAOYSA-N 251.374 3.163 70 20 CGID Cc1nccc(NC(=O)N2CC[C@H](C)[C@@H]2C)c1Cl 159647543 JWBPCPWZSRNYPK-WPRPVWTQSA-N 267.760 3.306 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(F)cc1C)[C@@H]1CCCO1 159541859 JEZQQAIUVIMQPJ-OCCSQVGLSA-N 280.343 3.213 70 20 CGID CC(C)(C)c1nsc(N2CCC3(CCC3)C2)n1 159954275 LUADOTCTHKAFHW-UHFFFAOYSA-N 251.399 3.216 70 20 CGID CC[C@@H](NC(=O)CC1CCSCC1)c1c(C)noc1C 159991090 ALPGIPGZFVXGLH-CYBMUJFWSA-N 296.436 3.392 70 20 CGID Fc1cc(Cl)ccc1CN[C@H]1CCN2CCCC[C@H]12 160715238 WSHYMKYYPAIJKK-LSDHHAIUSA-N 282.790 3.196 70 20 CGID Cc1ccc(C)c([C@@H](C)NCCCNC(=O)C(C)C)c1 159979046 ZGMOIJMEJLUROC-OAHLLOKOSA-N 276.424 3.116 70 20 CGID CCc1ccc(-c2cnn(CC3CCNCC3)c2)cc1 217237634 IVHLYHXNSSORGP-UHFFFAOYSA-N 269.392 3.112 70 20 CGID CC(C)N(C)C(=O)CN1CCC[C@H](C(C)(C)C)CC1 217224151 IBQHFBGAJMTLGH-AWEZNQCLSA-N 268.445 3.001 70 20 CGID O=C(c1ccco1)N1CC[C@H](Oc2ccccc2Cl)C1 161334633 FOPQNMPBPCBUJP-NSHDSACASA-N 291.734 3.227 70 20 CGID CC[C@H](N[C@H](CC)CO)c1cccc(Cl)c1F 161479981 VNQCNNNUMDJNMV-SKDRFNHKSA-N 259.752 3.291 70 20 CGID CC(C)n1nccc1C(=O)NC[C@@H](C)Cc1cccs1 160178554 MNBQVHIXYCSBTD-LBPRGKRZSA-N 291.420 3.134 70 20 CGID CC[C@@H]1CCCN(C(=O)c2c(F)cc(F)cc2F)C1 160317032 SUOFDJCZZHGNBE-SECBINFHSA-N 271.282 3.366 70 20 CGID C[C@H](CC(=O)NC(C)(C)c1nccs1)c1ccncc1 160636830 XCLGEMGDQDAQQG-LLVKDONJSA-N 289.404 3.083 70 20 CGID COC[C@H](C)NCc1ccnc(O[C@@H](C)CC(C)C)c1 160836508 XNXDBTRXWYSOFJ-KBPBESRZSA-N 280.412 3.020 70 20 CGID FC(F)(F)CN(Cc1cnc2ccccn12)CC1CCC1 160972359 ZLFRWJGBMOSJRU-UHFFFAOYSA-N 297.324 3.499 70 20 CGID CC(C)[C@@H]1OCC[C@H]1CNc1nc(C(C)(C)C)ns1 159839102 IORAEQFRHMWXEW-QWRGUYRKSA-N 283.441 3.309 70 20 CGID O=C(Oc1cc(Cl)ccc1Cl)[C@@H]1CCCCO1 159682401 MOZHUIWQBBYKNG-JTQLQIEISA-N 275.131 3.468 70 20 CGID C[C@@H]1C[C@H]1C(=O)Nc1cc(F)ccc1OC(F)F 159497947 FISZGPSONBDLGW-HTRCEHHLSA-N 259.227 3.022 70 20 CGID C[C@H](N[C@H]1CCCc2cc(F)ccc21)C(=O)NC(C)(C)C 159539825 RGAKDKWHGVPGOX-NHYWBVRUSA-N 292.398 3.096 70 20 CGID CCOCc1ccccc1CNc1cccc(F)n1 218120015 WYKIRVQCXITEFH-UHFFFAOYSA-N 260.312 3.369 70 20 CGID Cc1ccccc1OCCCNC(=O)NCCC(C)C 217300489 BXLYFMXDWIYKJR-UHFFFAOYSA-N 278.396 3.109 70 20 CGID CN(CCOc1ccc(Cl)cc1)Cc1cncs1 161154819 UGWDYXIYRBOPDO-UHFFFAOYSA-N 282.796 3.307 70 20 CGID CC[C@@H](SC)c1nc(Cc2ccc(OC)cc2)no1 161276435 WVLGUYBLTFNSJJ-GFCCVEGCSA-N 278.377 3.483 70 20 CGID Cc1nc(CC(=O)N2CCC[C@H]3CCC[C@H]32)c(C)s1 161324671 BTNXNPWGGBYZDW-TZMCWYRMSA-N 278.421 3.094 70 20 CGID CS[C@@H](C)CNC(=O)[C@H](C)Cc1cccc(Cl)c1 161375640 SPJMEILRLTZLTF-MNOVXSKESA-N 285.840 3.386 70 20 CGID CC[C@@H]1CCCC[C@H]1NC(=O)Cc1c(C)noc1Cl 160102885 FFCKKOKJFRFYLT-ZYHUDNBSSA-N 284.787 3.264 70 20 CGID CNC(=O)c1ccc(NC(=O)C[C@H](C)C(C)C)c(Cl)c1 160230205 SGDWKIBIAASHJM-JTQLQIEISA-N 296.798 3.320 70 20 CGID Cc1cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)ccc1F 159532716 HOBOMRSTCUHFCX-IMJJTQAJSA-N 275.367 3.181 70 20 CGID COc1cc(C)nc(CNc2ccc(F)c(OC)c2)c1 160286674 PGBRVUGMCCZLBI-UHFFFAOYSA-N 276.311 3.158 70 20 CGID CCOCCCN1CCC(N(C)c2ccccc2)CC1 159741512 WRULQXBGJDJDQY-UHFFFAOYSA-N 276.424 3.014 70 20 CGID Clc1cc(NCCN2CCCCCC2)nc(C2CC2)n1 217968320 DQSSEDPCJZCQKV-UHFFFAOYSA-N 294.830 3.295 70 20 CGID CC[C@H](N[C@H](C)C(=O)NCC(C)C)c1ccc(F)cc1F 161014769 CIDJTGXCMYSNEN-ABAIWWIYSA-N 298.377 3.166 70 20 CGID CCC[C@H](C)[C@@H]1CCCN1Cc1nnc(C)n1CCC 161428984 QYGBAEWPPQIIHA-ZFWWWQNUSA-N 278.444 3.397 70 20 CGID C[C@@H](NCCSc1ccc(Cl)cc1)[C@H]1CCOC1 160052880 DACSURIMADVIPA-NEPJUHHUSA-N 285.840 3.447 70 20 CGID Cc1ccoc1C(=O)N[C@H]1CCCc2sccc21 160104956 TUNSAIWSJVGGPI-NSHDSACASA-N 261.346 3.457 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccccc1N1CCCC1=O 160186350 QUTYRMJMMSAZPC-SJCJKPOMSA-N 286.375 3.188 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)C[C@H](C)C1CCCCC1 160677775 ZGUHUCZJTVLPIH-STQMWFEESA-N 283.412 3.051 70 20 CGID O=C(C[C@H]1C=CCC1)N1CCc2c(F)cccc2C1 160785158 KXCJOMVFOYCZJM-LBPRGKRZSA-N 259.324 3.067 70 20 CGID CCCC1(CNC(=O)c2cccc(-c3nnc(C)o3)c2)CC1 160793195 CEUQURKKLMFQAG-UHFFFAOYSA-N 299.374 3.355 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(C)c(F)c1)[C@H]1CCCO1 159418581 MKZFSGPPEKXGPA-ZIAGYGMSSA-N 280.343 3.213 70 20 CGID C[C@@H]1CCC[C@@H](C)N(C(=O)CCCn2cccc2)C1 159676290 SSLVRXZBYDCAJK-HUUCEWRRSA-N 262.397 3.305 70 20 CGID C[C@@H]1CCN(C(=O)NCCc2c[nH]c3ccccc23)C[C@@H]1C 159677463 ZYORBJLKMBIWGJ-KGLIPLIRSA-N 299.418 3.398 70 20 CGID CO[C@H](CNC(=O)CCCCSC)c1ccccc1 159397402 AFZZGSHEHLJGNI-CQSZACIVSA-N 281.421 3.024 70 20 CGID CN(C)c1ccc(CNCCc2ccc(Cl)cc2)cn1 159567103 ROYVPQPBYHJBIO-UHFFFAOYSA-N 289.810 3.133 70 20 CGID Cc1cccc([C@@H]2CCCN2CCc2ccncc2)n1 159753844 CSGSNGKLUGMGBF-KRWDZBQOSA-N 267.376 3.165 70 20 CGID O=C(CC1CC1)N(Cc1ccccc1)CC1(O)CCCC1 161256747 NNLXZNFJGCSYPJ-UHFFFAOYSA-N 287.403 3.120 70 20 CGID CCOCCC1(CNC(=O)N2CCC[C@H]2C2CCC2)CC1 161424311 GHEOOLYMXYEEDT-HNNXBMFYSA-N 294.439 3.167 70 20 CGID CCOc1ccc(Cl)cc1[C@H](C)NC1CCN(C)CC1 161455534 ZJCBGBWPQOGQBU-LBPRGKRZSA-N 296.842 3.484 70 20 CGID Cc1ccccc1[C@@H]1C[C@H]1NC(=O)NC1(C)CCC1 161459934 LLWWIQQBWAOZQM-UONOGXRCSA-N 258.365 3.093 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(OC(F)F)cc1 160128250 FNSVDLHUUNJZIB-UHFFFAOYSA-N 281.302 3.208 70 20 CGID CC(C)C[C@H]1CCCCN1C[C@H](O)COCc1ccco1 160325452 JXQUQPAQSMXVFB-CVEARBPZSA-N 295.423 3.058 70 20 CGID CC[C@@H](C)[C@@H](C)NC(=O)Nc1cc(C(=O)OC)cs1 160675744 RIPBOROMRASKEK-RKDXNWHRSA-N 284.381 3.091 70 20 CGID COCCc1nsc(N[C@@H]2CCCCC2(C)C)n1 160689403 SHLYHCFEZVGABD-SNVBAGLBSA-N 269.414 3.108 70 20 CGID CCn1ccnc1CN(Cc1ccccc1F)C1CC1 160710261 LNMMITZSBUFDDR-UHFFFAOYSA-N 273.355 3.207 70 20 CGID O=C(NC[C@H]1[C@H]2c3ccccc3C[C@H]21)NCC1(C2CC2)CC1 160728266 UHIKYQWYQFOKPD-BBWFWOEESA-N 296.414 3.062 70 20 CGID CCCCn1ncc(NC(=O)NCCC(C)C)c1C 159835712 ZMPPHAAZJRHVEC-UHFFFAOYSA-N 266.389 3.159 70 20 CGID CCCC1CCC(NC(=O)N(C)C[C@@H]2CCC[C@@H]2O)CC1 159921308 ZPYHEHJKVIDROX-GRAKBVBRSA-N 296.455 3.148 70 20 CGID CC(C)N(CCc1nccs1)C(=O)N[C@@H]1C=CCCC1 159793278 RYTFASUQHXTBGG-CYBMUJFWSA-N 293.436 3.214 70 20 CGID COc1cc(OC)nc(N[C@@H](C)c2cc(C)sc2C)n1 159778765 QAJYBRGDCOJTGU-VIFPVBQESA-N 293.392 3.345 70 20 CGID Cc1nn(C)cc1CNC(C)(C)CCc1ccccc1 160148547 ZNWRRKINQKCJIU-UHFFFAOYSA-N 271.408 3.230 70 20 CGID CCCn1nccc1CNc1ccc(F)cc1OC 160120586 QQQFVIYULRJXEN-UHFFFAOYSA-N 263.316 3.053 70 20 CGID O=C(NC[C@@H]1CCCN1c1ccccc1)c1ccccc1 217806643 UDROUSUZFHYRFX-KRWDZBQOSA-N 280.371 3.085 70 20 CGID CC[C@H](C)N(C)CCNCc1cc2cccc(OC)c2o1 217401222 IPOKATJWTPSKAN-ZDUSSCGKSA-N 290.407 3.261 70 20 CGID CSCCCNc1ccncc1Br 159848178 QNJQAWJXMZYXOV-UHFFFAOYSA-N 261.188 3.009 70 20 CGID CC(=O)c1ccc(OCC[C@H]2CCCCN2C)cc1 218178464 NUZLONUBJHJPII-OAHLLOKOSA-N 261.365 3.142 70 20 CGID CCCCc1nc(COc2ccc3[nH]ccc3c2)no1 160049358 PVIKMMVGWHVOLW-UHFFFAOYSA-N 271.320 3.473 70 20 CGID C[C@@H](CNC(C1CC1)C1CC1)N(C)Cc1ccccc1 160860068 MVCATLMQDYYJRE-AWEZNQCLSA-N 272.436 3.285 70 20 CGID C[C@@H]1CCC[C@@H](CNC(=O)N2CCCCCC2)C1 218050505 ALHUGOBTAWBXRN-ZIAGYGMSSA-N 252.402 3.398 70 20 CGID COc1cc(CN2CCC[C@@H](C)[C@@H]2C)cc(OC)c1O 217836766 XWPQQYPVBBNLGR-NEPJUHHUSA-N 279.380 3.030 70 20 CGID Cc1noc(C)c1CNC(=O)C(C)(C)C1CCCC1 161124999 SJFBLIDFMFBHAW-UHFFFAOYSA-N 264.369 3.124 70 20 CGID C[C@@H]1Sc2ccccc2N(Cc2nccn2C)[C@H]1C 161128707 BWIALLCXSNBBIW-RYUDHWBXSA-N 273.405 3.309 70 20 CGID CO[C@H](C(=O)N1CCC[C@@H]1c1ccncc1)c1ccccc1 161302320 QTXLBAAZMIAHTC-SJORKVTESA-N 296.370 3.133 70 20 CGID COC[C@H](NCC1(c2ccc(F)cc2)CC1)C(C)C 161371145 FPHZLNADJZFPII-HNNXBMFYSA-N 265.372 3.118 70 20 CGID C[C@H](Nc1ccc2oc(N(C)C)nc2c1)c1cccnc1 160042344 OYRXCVZVPDCOCO-NSHDSACASA-N 282.347 3.462 70 20 CGID CC[C@@H](C)CS[C@@H]1CCCN(CC(F)(F)F)C1=O 160045485 CPQCAUVGWLZRQZ-NXEZZACHSA-N 283.359 3.319 70 20 CGID CCN1CC[C@H](CNC(=O)C[C@@H]2CCCCC2(C)C)C1 160121938 KBEJGPVNLDSCJW-CABCVRRESA-N 280.456 3.051 70 20 CGID CCC[C@H](C(=O)N[C@H](C)CC(=O)OCC)c1ccccc1 160239568 HWSPMOAGIIIGNL-HIFRSBDPSA-N 291.391 3.028 70 20 CGID CCCCn1ncc(NC(=O)N(C)C2CCC2)c1C 160257146 UDJFVQHGSANRGN-UHFFFAOYSA-N 264.373 3.008 70 20 CGID CCN(C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)[C@H](C)C(C)C 160361198 YZBKSPCFUHDEFE-YUELXQCFSA-N 282.428 3.020 70 20 CGID C[C@@H](C(=O)N1CCCCCC1)c1c(F)cccc1F 160454342 VUXXAKRTVFCPJX-LLVKDONJSA-N 267.319 3.471 70 20 CGID CCOc1ccc([C@H](CC)NCC(C)(C)O)cc1OCC 160645481 KWQNHUAGEOTELJ-AWEZNQCLSA-N 295.423 3.296 70 20 CGID Cc1nc(N)sc1-c1nc([C@@H]2CCCCS2)no1 160646485 XZCAQWCDWCEKRP-ZETCQYMHSA-N 282.394 3.042 70 20 CGID COc1cc(C)c([C@@H](C)NCCOCC(C)C)cc1OC 160665187 JSSGQSDSVZIATQ-CQSZACIVSA-N 295.423 3.335 70 20 CGID COCC[C@H](C)NCc1ccnc(O[C@@H](C)CC(C)C)c1 160832446 KJKLANFKLJJFED-GJZGRUSLSA-N 294.439 3.410 70 20 CGID COc1ccc([C@@H]2CCN(Cc3nccn3C(C)C)C2)cc1 160896729 NDWPMAZYECRMGJ-MRXNPFEDSA-N 299.418 3.462 70 20 CGID COCC(C)(C)C(=O)N[C@H]1CCSc2c(F)cccc21 160941764 PVILCONIECUQPK-LBPRGKRZSA-N 297.395 3.151 70 20 CGID CCOC(=O)c1sc(NC(=O)[C@@H]2C[C@]2(C)CC)nc1C 159437663 BSWSOSOYWCIHJB-XPTSAGLGSA-N 296.392 3.003 70 20 CGID CN(Cc1ccc2ccccc2c1)[C@H](CN)C1CC1 159759137 DDINKPDVGBARGP-QGZVFWFLSA-N 254.377 3.009 70 20 CGID CC[C@H](N[C@H]1CCC[C@@H](O)C1)c1ccc(OC)c(OC)c1 217619673 ZEVJTEFPKDFIMC-ZNMIVQPWSA-N 293.407 3.048 70 20 CGID Cc1cc(C)nc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 160224429 HIZHSRSFEGFKOK-GUYCJALGSA-N 296.418 3.026 70 20 CGID CCn1nccc1CN(C)Cc1ccccc1Cl 160819555 MOEBZTDTNVDABZ-UHFFFAOYSA-N 263.772 3.188 70 20 CGID CCN1CCCC[C@H]1CN[C@@H](C)c1ccc(OC)c(F)c1 161171637 LVGRUUAEIDEPQF-ZFWWWQNUSA-N 294.414 3.359 70 20 CGID C[C@H]1CN(C(=O)C(C)(C)C2CCCC2)CC(C)(C)O1 161232208 JRMIDPJNCXJNFP-LBPRGKRZSA-N 267.413 3.229 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)CC(F)(F)F)o1 161325425 VJKDTZVIIZLUFV-JTQLQIEISA-N 291.269 3.042 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)c1coc(Br)c1 161459941 NWKBIZGCJGWDQU-HTQZYQBOSA-N 272.142 3.055 70 20 CGID CC[C@H](C)CN(C)C(=O)Nc1ccn(CCC(C)C)n1 161506215 LQXHPWXLZDKJIN-ZDUSSCGKSA-N 280.416 3.439 70 20 CGID CC(C)(C)[C@H](CC1CCCCC1)NC(=O)CCCN 160073880 ZNMHERXUQYOKLS-AWEZNQCLSA-N 268.445 3.227 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccccc1N1CCCC1=O 160186092 QUTYRMJMMSAZPC-PXAZEXFGSA-N 286.375 3.188 70 20 CGID CC1(C)C[C@@H](Nc2c(F)c(F)nc(F)c2F)CCO1 160650736 YAPKQKZTGZUBPP-LURJTMIESA-N 278.249 3.008 70 20 CGID CC[C@H](NCCOCC(C)C)c1ccc2c(c1)OCCO2 160690077 AHUDDAXOMAEHKX-HNNXBMFYSA-N 293.407 3.171 70 20 CGID COCc1ccccc1C(=O)NCCCSCC(C)C 160727324 VVCRNKGQHUYIME-UHFFFAOYSA-N 295.448 3.342 70 20 CGID C[C@@H]1CN(C(=O)NC[C@@H]2Cc3ccccc32)CC[C@H]1C 160825517 GBUFUEWWTUUFJM-NFAWXSAZSA-N 272.392 3.014 70 20 CGID C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccccc23)C[C@@H]1C 159677574 ZYORBJLKMBIWGJ-KBPBESRZSA-N 299.418 3.398 70 20 CGID CCS[C@@H]1CCCCN(C(=O)CCCn2cccc2)C1 159503465 QSSUZCFEYVPOOD-OAHLLOKOSA-N 294.464 3.403 70 20 CGID CCC(CC)N(CCOC)Cc1c(C)nc2ccccn12 159707031 WFDYRQASPAIMCY-UHFFFAOYSA-N 289.423 3.280 70 20 CGID CSc1cc(C(=O)N(C)c2ccccn2)ccc1F 159965743 UBLABCYCAWRLQG-UHFFFAOYSA-N 276.336 3.219 70 20 CGID CCONC(=O)c1cc(NC(=O)CC(C)C)ccc1Cl 159595334 SWQYLDIYXSGJCR-UHFFFAOYSA-N 298.770 3.006 70 20 CGID Fc1cc(Cl)ccc1CNC[C@H]1CCN(C2CC2)C1 160767307 PYWMDGZXFRPDPM-LLVKDONJSA-N 282.790 3.053 70 20 CGID Cc1c(C(=O)OC2CCCC2)cnn1-c1ccccc1 217043316 SQJQIMQFGPOHSK-UHFFFAOYSA-N 270.332 3.280 70 20 CGID CC1(NCC2CCN(C(=O)OC(C)(C)C)CC2)CCC1 159922267 XWIUSILINCEMOR-UHFFFAOYSA-N 282.428 3.166 70 20 CGID CC[C@H]1CCCCN1C(=O)NCCOc1ccccc1 217303622 VFCIYGZNHVVBQA-AWEZNQCLSA-N 276.380 3.040 70 20 CGID O=C(c1ccc2cc[nH]c2c1)N1[C@H]2C=CC[C@H]1CC2 218728883 IQHOLDNDZCSYHT-KBPBESRZSA-N 252.317 3.101 70 20 CGID COC[C@@H](NC(=O)[C@H](C)Cc1ccccc1Cl)C1CC1 161251600 MJLIPRGKVMVBMQ-IAQYHMDHSA-N 295.810 3.060 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCCc3occc32)cn1 161385535 JCNKOAJLHRMIQD-ZDUSSCGKSA-N 271.320 3.182 70 20 CGID Cc1ccc([C@@H]2CCCCCN2CCn2ccnc2)o1 159844316 BGGZFESWNXZNPX-HNNXBMFYSA-N 273.380 3.402 70 20 CGID C[C@H](CC(=O)NCC1(N)CCCCC1)c1cccc(F)c1 159546891 HHYLXDUXKSLMCM-CYBMUJFWSA-N 292.398 3.097 70 20 CGID CS[C@@H](C)CC(=O)NCCCCOc1ccc(C)cc1 159969035 VTQYGFBZLWJMPT-AWEZNQCLSA-N 295.448 3.412 70 20 CGID CCOC(=O)C1(C(=O)Nc2cccc(C)c2Cl)CCC1 159574148 XIXXECLOQUHUCN-UHFFFAOYSA-N 295.766 3.320 70 20 CGID Cc1cc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)ccc1F 159532984 HOBOMRSTCUHFCX-BMFZPTHFSA-N 275.367 3.181 70 20 CGID C[C@H](NCCCN1CCCC[C@@H]1C)c1cncc(F)c1 160276598 AQQLPOAZGDOVLX-KBPBESRZSA-N 279.403 3.136 70 20 CGID CCS[C@H]1CC[C@H](N(C)C(=O)NC2CCCC2)C1 161434576 QUGKYBCQPZZCQD-STQMWFEESA-N 270.442 3.245 70 20 CGID Cc1cscc1C(=O)N1CCc2c(F)cccc2C1 161015616 OZRAAWMFSUCYCZ-UHFFFAOYSA-N 275.348 3.394 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)c2cc(F)ccc2O)C1 161166219 FOMVFDIUDKKHRN-LBPRGKRZSA-N 279.355 3.430 70 20 CGID CS[C@H](C)CNC(=O)[C@H](C)Cc1cccc(Cl)c1 161375409 SPJMEILRLTZLTF-GHMZBOCLSA-N 285.840 3.386 70 20 CGID CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1C[C@@]1(C)CC 160025237 ICXRCLZMHCSJRZ-CXAGYDPISA-N 289.375 3.200 70 20 CGID Cc1cnc(CCN(C)c2nc(C(C)(C)C)ns2)s1 160107287 YOZQGPMSIMJRTP-UHFFFAOYSA-N 296.465 3.279 70 20 CGID COC(=O)c1csc(NC(=O)N(C)[C@H](C)C2(C)CC2)c1 160714175 KVKAXLSXZDGHEL-SECBINFHSA-N 296.392 3.187 70 20 CGID Cc1occc1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 160780014 DEWHMDDGBVSLCH-CYBMUJFWSA-N 277.364 3.200 70 20 CGID CC(C)(C)c1ccccc1NC(=O)N[C@]1(C)CCOC1 159427252 LHSNWTNFVFXABB-MRXNPFEDSA-N 276.380 3.285 70 20 CGID CC[C@@H](NC(=O)Nc1ccccc1SC)[C@H]1CCCO1 159433067 VSAFPFPBOLFSDL-DGCLKSJQSA-N 294.420 3.488 70 20 CGID CC1(NC(=O)N[C@H]2CCc3cc(F)ccc32)CCC1 159932801 IYWBTELBTGWFPM-ZDUSSCGKSA-N 262.328 3.055 70 20 CGID CCCCOC(=O)[C@H](C)N1CCC(OC2CCCC2)CC1 159977378 WDJJGQOAOBLVTN-AWEZNQCLSA-N 297.439 3.142 70 20 CGID CCc1oc(C(=O)Nc2ccnn2CC(C)C)cc1C 159594851 SXUSPMSKAWHKLO-UHFFFAOYSA-N 275.352 3.255 70 20 CGID CCC(CC)(CO)CNC(=O)Nc1ccc(Cl)cc1 159799546 ODTJBAYQOSPFDL-UHFFFAOYSA-N 284.787 3.260 70 20 CGID COc1ccc([C@@H](C)N[C@@H]2CCOC(C)(C)C2)c(F)c1 159952476 LBGFUWGIIPWTGO-VXGBXAGGSA-N 281.371 3.443 70 20 CGID CCOC(CCN[C@@H](C)c1cccc(C)c1)OCC 160241318 FDROERNPOPMYPM-AWEZNQCLSA-N 265.397 3.435 70 20 CGID CC1(C(=O)Nc2cc(F)c(Br)cc2F)CC1 160938485 MIAUTSPRJYNOLJ-UHFFFAOYSA-N 290.107 3.466 70 20 CGID CCC(CC)CC(=O)Nc1cccc(S(=O)(=O)F)c1 809281026 NKMVAUIRXTXXJN-UHFFFAOYSA-N 287.356 3.110 70 20 CGID CC(C)CC(=O)N1CCOc2ccc(Br)cc21 217258155 QQJHOTAGMLEPJU-UHFFFAOYSA-N 298.180 3.221 70 20 CGID CC[C@H](O)CCNC(=O)[C@@H](c1ccccc1)[C@@H](C)CC 218095027 LALIVICMCSUGSA-CWRNSKLLSA-N 277.408 3.094 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)Cc1c(C)nn(C)c1C 161282678 AMZVEYYBXVLIFT-HOCLYGCPSA-N 291.439 3.007 70 20 CGID CCCn1c(C)nnc1CN1CCC[C@@H]1c1cccc(C)n1 161394850 XHGXSGIDGJDLEY-MRXNPFEDSA-N 299.422 3.037 70 20 CGID CC[C@@H](NC[C@@H](C)N1CCc2ccccc2C1)C1CC1 159833609 IDAVENHFCABAKH-RDTXWAMCSA-N 272.436 3.211 70 20 CGID Cc1ccc(F)c(NC(=O)N(C)[C@@H]2CCSC2)c1 159476713 HFUOZDJSUDSKLQ-SNVBAGLBSA-N 268.357 3.103 70 20 CGID O=C(CC1CC1)Nc1cc(F)ccc1OC(F)F 159491527 OQGBOOSQUHBXQP-UHFFFAOYSA-N 259.227 3.166 70 20 CGID CCCc1ccccc1NC(=O)[C@H]1CCn2ccnc2C1 159711893 QTLHVONHKIYATK-AWEZNQCLSA-N 283.375 3.037 70 20 CGID CCCC(=O)Nc1cccc(CN[C@@H](COC)C(C)C)c1 159922379 LVMZSHGXGWFGDT-INIZCTEOSA-N 292.423 3.186 70 20 CGID COc1ccc2c(c1)C[C@@H](N[C@@H]1CCCSC1)CC2 159567071 OWCZFDXOQTVKDJ-LSDHHAIUSA-N 277.433 3.038 70 20 CGID O=C(NC1(CO)CCCC1)c1cc2ccc(F)cc2s1 161192516 QCCNHBSOKJNLIX-UHFFFAOYSA-N 293.363 3.075 70 20 CGID CC[C@H](NC(=O)[C@H]1CCCCO1)c1cccc(Cl)c1 161066402 YFROOYHKBWAKPS-UONOGXRCSA-N 281.783 3.476 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@@H]1CCCS1 161140677 USDXPETZPONKKF-AGIUHOORSA-N 255.427 3.309 70 20 CGID CC[C@@H](CO)N[C@@H](CC)c1cccc(Cl)c1F 161479853 VNQCNNNUMDJNMV-CABZTGNLSA-N 259.752 3.291 70 20 CGID C[C@H](C1CC1)N(C(=O)COc1ccc2[nH]ccc2c1)C1CC1 160024531 SJUTWRQXQOPFRV-GFCCVEGCSA-N 298.386 3.336 70 20 CGID CCO[C@H](CC)C(=O)N[C@@H]1CCCc2sccc21 160145346 IFCHGPRHPFAXBN-VXGBXAGGSA-N 267.394 3.057 70 20 CGID Cc1cccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)c1F 160153109 KAFWZYOPTMRGIZ-ZDUSSCGKSA-N 291.366 3.356 70 20 CGID Cc1cc(C)cc(OCCC(=O)NCC2(C3CC3)CC2)c1 160205262 GHPPGZKJNTVZKV-UHFFFAOYSA-N 287.403 3.379 70 20 CGID COc1cccc2cc(C(=O)N(C)Cc3cccn3C)oc12 160464975 KLGRALHPOZDGBJ-UHFFFAOYSA-N 298.342 3.052 70 20 CGID CCCCO[C@H]1C[C@@H](N[C@@H](CC)c2cnn(C)c2)C1(C)C 159767355 HODKWEBKEJUXJY-XHSDSOJGSA-N 293.455 3.445 70 20 CGID Cc1cccc2nc(CNC(=O)CC3=CCCCC3)n(C)c12 159774063 GHCBPEBVSLQSTN-UHFFFAOYSA-N 297.402 3.388 70 20 CGID CCO[C@H]1C[C@H](Nc2ccc(F)c(OC)c2)C1(C)C 160103676 QOBKMTLBXUZRNH-KBPBESRZSA-N 267.344 3.450 70 20 CGID COC(=O)c1ccc(C)c(NC(=O)c2cc(C)ccc2O)c1 218332601 KDTWJUCKWRITMT-UHFFFAOYSA-N 299.326 3.048 70 20 CGID CC(C)C[C@@H]1CCCCCN1C(=O)CCNC(C)C 161298178 DRDOUUOEMPCQBZ-HNNXBMFYSA-N 268.445 3.192 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)NCc1nc2ccccc2s1 161406595 GJDVFDPTYNBXCE-PHIMTYICSA-N 289.404 3.379 70 20 CGID Cc1nc(CC(=O)N[C@H]2CCCc3sccc32)cs1 160050138 NTLKGJCNBPDVGX-LBPRGKRZSA-N 292.429 3.249 70 20 CGID Cc1csc(CNC(=O)CCCc2sccc2C)n1 160617670 UVWZUQIOBOKLKF-UHFFFAOYSA-N 294.445 3.461 70 20 CGID CCc1ccc([C@@H](CO)Nc2ccnc(C3CC3)n2)cc1 160900772 DDAZIOBAWIQRHS-OAHLLOKOSA-N 283.375 3.062 70 20 CGID O=C(O[C@@H](c1ccccn1)C(F)(F)F)C1CCC1 159939535 CPAUVQVNKAXGBS-JTQLQIEISA-N 259.227 3.028 70 20 CGID Cc1ccccc1[C@H](C)NCCc1c(C)noc1C 159466158 CQWHPAKYEUHMNT-LBPRGKRZSA-N 258.365 3.493 70 20 CGID Cc1cc(F)c(C(=O)NCCOc2ccccc2)cc1F 159533270 SMIQNHYTVYGMEW-UHFFFAOYSA-N 291.297 3.082 70 20 CGID CC(C)(C)NC(=O)N[C@H]1CCSc2c(F)cccc21 159763352 RCXLAKKRIZTQJC-NSHDSACASA-N 282.384 3.460 70 20 CGID CCCCOC[C@@H](CS(=O)(=O)Cl)C(C)(C)C 114478358 QTXMREFJNFICNF-JTQLQIEISA-N 270.822 3.034 70 20 CGID CCCC1(C(=O)Nc2cccc(S(=O)(=O)F)c2)CCC1 809282463 HFDQBMCHZOZTRG-UHFFFAOYSA-N 299.367 3.254 70 20 CGID COc1cccc2c1CC[C@H]2NC(=O)Nc1ccc(C)nc1 161303816 NMJPHUXYPHITAX-OAHLLOKOSA-N 297.358 3.208 70 20 CGID CCc1noc(C)c1CSCCOCC(F)(F)F 160084311 WFABMQHBSWZOMR-UHFFFAOYSA-N 283.315 3.358 70 20 CGID C[C@H]1OCC[C@H]1Sc1nc(C(C)(C)C)ns1 160099158 PTLSEMRBVUVHKH-HTQZYQBOSA-N 258.412 3.105 70 20 CGID CCCC1(CNC(=O)NCC2(CCOCC)CC2)CCC1 160299229 JZVBLLLFKDMQRD-UHFFFAOYSA-N 296.455 3.463 70 20 CGID CC[C@@H](NC(=O)Nc1cc(F)ccc1C)[C@H]1CCCO1 159405627 SOLMXLUYXPZGDC-TZMCWYRMSA-N 280.343 3.213 70 20 CGID Cc1cnc([C@H](C)NC(=O)NCC2(C3CC3)CC2)s1 159408325 ZTWNQJBOCVKPKR-JTQLQIEISA-N 279.409 3.002 70 20 CGID CSc1ccccc1NC(=O)NCCc1cscn1 159489928 SARNRLKWPNVHIG-UHFFFAOYSA-N 293.417 3.229 70 20 CGID CC(C)CCn1ccc(NC(=O)N2CC[C@H](C)[C@H]2C)n1 159694915 BAOCZWYWDWXKCT-QWHCGFSZSA-N 278.400 3.191 70 20 CGID CCC[C@H](C)C(=O)N[C@@H]1CCOC2(CCCC2)C1 159537754 XQMLKWAZWCSFCE-QWHCGFSZSA-N 253.386 3.031 70 20 CGID COc1c(F)cc(NC(=O)N2CC[C@H](C)[C@H](C)C2)cc1F 159737727 WKYCILBBGUKOAH-VHSXEESVSA-N 298.333 3.483 70 20 CGID CCCn1nccc1CNc1ccccc1OCC 159956103 UTCAAFXUPAKFPI-UHFFFAOYSA-N 259.353 3.304 70 20 CGID C[C@@H](Cc1ccccc1F)NC1CCC2(CC1)OCCO2 161343571 URGIDLPXHJBQPZ-ZDUSSCGKSA-N 293.382 3.032 70 20 CGID Cc1cc(C)c([C@@H](C)N2CCC[C@@H](CN)C2)c(C)c1 217510067 QRRSULBZKRZEJD-CVEARBPZSA-N 260.425 3.344 70 20 CGID CCc1noc(C)c1C[S@](=O)c1cccc(C)c1 161068311 KDUIJMQZMRVDTK-GOSISDBHSA-N 263.362 3.162 70 20 CGID COc1ccccc1C(=O)N[C@@H]1CCc2c(OC)cccc21 160056668 HZVJKZDDMHCUEM-OAHLLOKOSA-N 297.354 3.121 70 20 CGID COc1cccc([C@@H](C)CC(=O)NCC2(C3CC3)CC2)c1 160102595 GOIPQKFHWHOGFM-ZDUSSCGKSA-N 287.403 3.495 70 20 CGID CO[C@H](C(=O)OCc1nc(C)sc1C)c1ccccc1 160372468 VBACETDPUMVYMD-AWEZNQCLSA-N 291.372 3.191 70 20 CGID CCC[C@H](C)CC(=O)N(C)c1ccc2c(c1)OCO2 160582894 JVZMKLOKVYYLTQ-NSHDSACASA-N 263.337 3.204 70 20 CGID CCS[C@H](C(=O)N(C)c1ccc2c(c1)OCO2)C(C)C 160640851 JSRMTGDJWILLJM-AWEZNQCLSA-N 295.404 3.156 70 20 CGID CC1(NC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CCC1 160696125 HPNYFWUXPQMLFW-LSDHHAIUSA-N 288.391 3.149 70 20 CGID CC[C@H](NC(=O)Nc1ccccc1SC)[C@@H]1CCCO1 159432673 VSAFPFPBOLFSDL-AAEUAGOBSA-N 294.420 3.488 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)NCCc1cccc(Cl)c1 159839451 FLIIAIFRNYFMJC-DZGCQCFKSA-N 265.784 3.435 70 20 CGID COCC(C)(C)C(=O)NCCSCc1ccc(C)cc1 159695348 MPVMQAQGXSAYTC-UHFFFAOYSA-N 295.448 3.017 70 20 CGID CC1(C)Cc2cccc(CN3CCCC[C@H]3CCO)c2O1 159720272 MSTYRFMFDMFMLK-INIZCTEOSA-N 289.419 3.137 70 20 CGID Cc1cnccc1CCNC(=O)NC[C@@H]1CCC[C@H](C)C1 159925519 HQBLAKICAUEHJX-DZGCQCFKSA-N 289.423 3.058 70 20 CGID C[C@H](C(=O)Nc1cccc([S@@](C)=O)c1)c1ccsc1 159740703 QASIKKXOBLFVLL-OVWNDWIMSA-N 293.413 3.228 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1ccc(F)cc1F 160079601 QFODEDXSFKEGQS-RYUDHWBXSA-N 270.367 3.346 70 20 CGID COC(=O)C[C@@H](C)SC/C=C\c1ccccc1 217367656 WQFVMYLEPNLNSO-OJIASSBASA-N 250.363 3.385 70 20 CGID CN(CCn1ccnc1)Cc1cccc2ccccc12 159757279 KAZINNJLYJRPFD-UHFFFAOYSA-N 265.360 3.168 70 20 CGID CC[C@@H](N[C@@H](C)c1nnc(C)o1)c1ccc(F)cc1F 161002181 OARDBOKMIDSOEQ-ISVAXAHUSA-N 281.306 3.458 70 20 CGID CCc1cccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1 161048201 WZLFAZOGOYLKGN-HOTGVXAUSA-N 288.391 3.328 70 20 CGID CCC[C@@H]1[C@H](C)CCCN1C(=O)NCC1(CCOC)CC1 161125479 LPJYTAJFIVJLIP-HUUCEWRRSA-N 296.455 3.413 70 20 CGID CS[C@H](C)CC(=O)NCCc1ccc(C)cc1C 161232568 ATHUVTWFHNZJEY-CYBMUJFWSA-N 265.422 3.104 70 20 CGID CC(C)C1(CNC(=O)C[C@H](C)c2ccncc2)CC1 161434738 URIGHPVTWVQLRP-ZDUSSCGKSA-N 260.381 3.128 70 20 CGID CCOCCC1(C(=O)N[C@H]2CCCc3occc32)CCC1 161498629 DBODLEMANFVISF-AWEZNQCLSA-N 291.391 3.370 70 20 CGID CCc1noc(C)c1CS[C@@H](C)C(=O)NC(C)(C)CC 160021064 ISAKHOMDOKXXBV-NSHDSACASA-N 298.452 3.472 70 20 CGID COc1ccc2ccc(OC(=O)[C@H]3CCCCO3)cc2c1 160148387 YTSQYPFWAMCCRF-MRXNPFEDSA-N 286.327 3.323 70 20 CGID COCCNC(=O)Nc1ccc(C)c(OCCC(C)C)c1 160466568 HMWMNPFJFKRNOG-UHFFFAOYSA-N 294.395 3.188 70 20 CGID CCCc1csc(NC2CCN(C(=O)OCC)CC2)n1 160641646 QNOTYKILFQQRQP-UHFFFAOYSA-N 297.424 3.128 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1ccccc1C 160658421 DXIVGVPZBZVYOK-UHFFFAOYSA-N 285.391 3.483 70 20 CGID CC(C)c1ccsc1C(=O)N(C)Cc1cccn1C 160707478 WPHRTSLYLJPASG-UHFFFAOYSA-N 276.405 3.482 70 20 CGID COc1ccc(Br)cc1CS[C@H](C)CO 160710184 LXPFCMRIWZSHIT-MRVPVSSYSA-N 291.210 3.072 70 20 CGID CC[C@@H](NCCCCN1CCC[C@@H]1CO)C1CCCCC1 160761381 WADDDWDJTYIHBJ-QZTJIDSGSA-N 296.499 3.172 70 20 CGID Cc1c(C(=O)NC[C@@H]2CCC[C@@H](C)C2)cnn1CC(C)C 160896622 QXBOVYLPRCMPTG-UKRRQHHQSA-N 291.439 3.404 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)c1cc(C)nc2onc(C)c12 159606736 HVCQRGKDBRISCM-DGCLKSJQSA-N 287.363 3.148 70 20 CGID C[C@@H](CN[C@@H](C)C1(C)CC1)N1CCc2ccccc2C1 159829040 JXGOXZHNKCTKGK-GJZGRUSLSA-N 272.436 3.211 70 20 CGID COc1ccc(N(C)C(=O)c2ccccn2)cc1Cl 159981132 FDAXFLVEGXNVSC-UHFFFAOYSA-N 276.723 3.020 70 20 CGID CC(C)[C@@H](N)c1noc(C2C3CC4CC(C3)CC2C4)n1 160249865 QPXOHQHNXNHGTH-QCYUVGAGSA-N 275.396 3.265 70 20 CGID CC(C)Cc1ccc(CCC(=O)N(C)CC[C@H](C)O)cc1 160129787 OKAVIDOOCQJOSF-HNNXBMFYSA-N 291.435 3.047 70 20 CGID CCCCNC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 160185047 OGBWAGXSMUUDJY-YPMHNXCESA-N 282.409 3.020 70 20 CGID CC[C@H](C)c1cc(C(=O)N2CCC[C@H]2c2ccc[nH]2)on1 160312951 CYRHQZALESESOP-FZMZJTMJSA-N 287.363 3.494 70 20 CGID C[C@@H](CCc1ccc(F)cc1)NC[C@H]1CCCC[C@@H]1O 160643861 OAAGZBARIOUCFM-LXZKKBNFSA-N 279.399 3.288 70 20 CGID C[C@@H](c1ccccc1Cl)N(Cc1nncn1C)C1CC1 160805958 QLTFQWKWEFWCOI-NSHDSACASA-N 290.798 3.194 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)CCCc1ccccn1 159802367 VQLTTWWIQYRDPM-HIFRSBDPSA-N 260.381 3.099 70 20 CGID c1cnc(-n2cncn2)c(NCc2coc3ccccc23)c1 159820992 BMOPGLNXCCCWIZ-UHFFFAOYSA-N 291.314 3.021 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCCOCC1CC1 159847641 PVKJPSIXCPUUFW-ZIAGYGMSSA-N 293.432 3.093 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N1CCN(c2ccccc2C)CC1 159711405 CQUJXUWRXUOVCR-MAUKXSAKSA-N 286.419 3.080 70 20 CGID Cc1cnccc1N[C@@H]1CCCc2cc(N)ccc21 159502553 PCXCGMZGDHHINO-MRXNPFEDSA-N 253.349 3.462 70 20 CGID C[C@@H]1CCC[C@@](CN[C@H](C)c2cscn2)(N(C)C)C1 218232509 IYTSANPQXFTSAU-UMVBOHGHSA-N 281.469 3.304 70 20 CGID CC[C@H](C)[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1 218775790 PZGMQAZGFUZPFS-SGMGOOAPSA-N 285.815 3.104 70 20 CGID Cc1ccc([C@@H](C)N(C)C(=O)[C@@H]2CCCCO2)cc1 161117995 BJDFCLZJEQJLMX-HIFRSBDPSA-N 261.365 3.084 70 20 CGID Cc1ccc(CNC2CCN(C3CCCCC3)CC2)cn1 161260030 FWMNODBKJAJKKF-UHFFFAOYSA-N 287.451 3.277 70 20 CGID O=C(NC1CC1)N[C@H](c1c(F)cccc1F)C(F)(F)F 161509100 KTELRHRCPJNDAE-SNVBAGLBSA-N 294.223 3.030 70 20 CGID CC(C)n1nccc1C(=O)N1CCCC(C)(C)CC1 160048574 UOYBVRGGFGIWLS-UHFFFAOYSA-N 263.385 3.116 70 20 CGID Cc1nnc(NC(=O)C[C@H](C)c2ccc(F)cc2F)s1 160161413 IBJOYOFDLMHEIC-ZETCQYMHSA-N 297.330 3.257 70 20 CGID C[C@H]1C[C@@H](NCC2(Sc3ccccc3)CC2)CCN1C 160476137 OMWSFKPFOYIPRP-GJZGRUSLSA-N 290.476 3.384 70 20 CGID C[C@@H](CC(=O)N(C)c1ccc(Cl)cn1)c1ccncc1 160502121 NMPCUUCGLIIFMX-NSHDSACASA-N 289.766 3.287 70 20 CGID CCCN(CCN(CC)CC)C(=O)Nc1ccccc1F 160538722 ZIBIULRFTGHXMP-UHFFFAOYSA-N 295.402 3.411 70 20 CGID Cc1cccc2c1CCN2C(=O)c1cnn(CC(C)C)c1C 160576439 UIVJZWXXBFWZAQ-UHFFFAOYSA-N 297.402 3.359 70 20 CGID CC(C)C[C@H](CO)NC(=O)CCc1ccc2ccccc2c1 160814751 AAXOGWIVDFKJAP-GOSISDBHSA-N 299.414 3.296 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(N2CCCCC2)cn1 160835014 FCUZUCQDGSFVOB-LBPRGKRZSA-N 293.436 3.152 70 20 CGID Cc1cccc([C@@H]2CCCN2C[C@H](O)c2ccccc2)n1 159807623 ZOADXENTSQSYEW-ROUUACIJSA-N 282.387 3.261 70 20 CGID CN(C)c1ccc(CN[C@@H](c2ccccc2)C2CC2)cn1 159660413 IRPVCTULUBUSGJ-SFHVURJKSA-N 281.403 3.389 70 20 CGID CCOCCCCNC(=O)NCC1CCC(C)(C)CC1 159924954 AXVGZZJYWLJMET-UHFFFAOYSA-N 284.444 3.319 70 20 CGID COCC(C)(C)C(=O)N(C)Cc1ccc(Cl)s1 159529935 UEVKENILDQAVFX-UHFFFAOYSA-N 275.801 3.033 70 20 CGID C[C@H](NCCCN1CCCCCC1=O)c1ccccc1 159553952 SBJZZYHILOCSIO-HNNXBMFYSA-N 274.408 3.130 70 20 CGID CCCCO[C@@H]1C[C@H](N[C@@H]2CCN(C)[C@H](C)C2)C1(C)C 159767648 YNINTOZDQVTZKB-LVQVYYBASA-N 282.472 3.043 70 20 CGID CCCC(O)(CCC)CC(=O)N(C)CCC(C)C 159573722 FNXGRHDCIQHJOG-UHFFFAOYSA-N 257.418 3.212 70 20 CGID CC[C@H](NC1CCC(c2ccccc2)CC1)C(=O)OC 159489007 WQXKKLCCAYSTBF-GPANFISMSA-N 275.392 3.254 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)Cc1cccc(Cl)c1 161413291 LVFYHABQWKMAOP-QWRGUYRKSA-N 251.757 3.282 70 20 CGID C[C@H]1[C@H](C)CCN1C(=O)CCc1ccc(F)cc1F 160711418 NTRRHBSJMKJRML-MNOVXSKESA-N 267.319 3.154 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccc(F)cc1F 217658645 MNDHLVASQINRJO-XZJROXQQSA-N 280.362 3.242 70 20 CGID CCCCOC(=O)c1cnc(Cl)c(Br)c1 218678021 NAUOFEBCAZYDRT-UHFFFAOYSA-N 292.560 3.454 70 20 CGID CC(C)(C)c1noc(-c2csc([C@@H]3CCCO3)n2)n1 161440422 VLDQGQSJUMBYFW-VIFPVBQESA-N 279.365 3.342 70 20 CGID COc1ccc(CN2CC[C@H]3OCCC[C@@H]3C2)cc1Cl 161447348 DWQFSSQNMJAIFQ-UKRRQHHQSA-N 295.810 3.350 70 20 CGID CCC[C@H](NC(=O)[C@H]1C[C@@]1(C)CC)C(=O)OC(C)(C)C 161470599 RWLZDSSUTKQQGL-BFQNTYOBSA-N 283.412 3.049 70 20 CGID Cc1cccc2[nH]cc(CC(=O)NCC3(C4CC4)CC3)c12 160189215 XPTGTYDTDBNDBG-UHFFFAOYSA-N 282.387 3.325 70 20 CGID CC(=O)Nc1cccc([C@@H](C)NC[C@@H]2CCC(C)(C)O2)c1 160223541 LTSNVTMEUBMCEH-WBMJQRKESA-N 290.407 3.253 70 20 CGID C[C@@H]1CCCC[C@@H]1N(C)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1 160384760 UYOLZRAFMNMJQP-OJLVUWQFSA-N 294.439 3.164 70 20 CGID CC[C@H](COC)NCC1(Sc2ccccc2)CC1 160506105 ZBEMYIHVEHXWNJ-CYBMUJFWSA-N 265.422 3.326 70 20 CGID O=C(Cc1cccs1)N1CCc2c(F)cccc2C1 160850374 LHWLUPAUGDTNMF-UHFFFAOYSA-N 275.348 3.015 70 20 CGID CC(C)CCC(=O)N[C@H]1CCOC2(CCCCC2)C1 160974846 JHVPLUDRZAWLLT-AWEZNQCLSA-N 267.413 3.421 70 20 CGID COc1ccccc1NC(=O)[C@@H](C)Sc1ccncc1 159949848 CEZWVRUDAOIWLA-LLVKDONJSA-N 288.372 3.210 70 20 CGID CCN(CC[C@@H]1CCCN1C)Cc1ccc(OC)cc1 161423267 KRXVJRMQTAIRQL-INIZCTEOSA-N 276.424 3.001 70 20 CGID CC(C)[C@H](C)CC(=O)N1CCc2c(F)cccc2C1 161074160 BHXGWWHCSIAXRQ-GFCCVEGCSA-N 263.356 3.393 70 20 CGID CCCN(CCO)Cc1cc(C)c(C)cc1OC(F)F 161230647 UHQCAUWKKDTKBE-UHFFFAOYSA-N 287.350 3.109 70 20 CGID CNC[C@@H](C)C(=O)N1CCCC[C@@H]1c1cccc(C)c1C 161338464 OMZIZDFRFQKVRE-RHSMWYFYSA-N 288.435 3.213 70 20 CGID COCC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 161429550 RBNQZDWFQZGPGN-UHFFFAOYSA-N 293.269 3.342 70 20 CGID CC1(C)Cc2cc(CNCC3(CO)CCCC3)ccc2O1 160093515 IVCUTFBRLAXIPJ-UHFFFAOYSA-N 289.419 3.042 70 20 CGID Cc1nc2ccccn2c1CN1CCc2ccccc2CC1 160471720 DMXMNTYWCNVCIR-UHFFFAOYSA-N 291.398 3.244 70 20 CGID COC(=O)CN(Cc1ccco1)c1cccc(Cl)c1 160483551 LGYDPNZYADHLFP-UHFFFAOYSA-N 279.723 3.113 70 20 CGID CN(Cc1cccn1C)C(=O)c1cnc(C(C)(C)C)s1 160553325 DTDJKZOUVLAQBW-UHFFFAOYSA-N 291.420 3.051 70 20 CGID CC(=O)c1c(F)cccc1N[C@@H]1CCOC(C)(C)C1 160633230 NONRRSXFEUMXRJ-LLVKDONJSA-N 265.328 3.398 70 20 CGID Cn1ccnc1CC1CCN(c2nccc3occc23)CC1 160683575 LQDWYQPODAPUQE-UHFFFAOYSA-N 296.374 3.020 70 20 CGID CC[C@@H](NC1CCN(C(=O)OC)CC1)c1ccc(F)cc1 160819680 RDUHRSZGXLVKEI-OAHLLOKOSA-N 294.370 3.097 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)[C@H](C)c2ccccn2)o1 159484549 QCHHNAJPSMWMBT-OCHBPSSRSA-N 284.359 3.470 70 20 CGID Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@@H]1CCCNC1 159693819 WXYLECHYZVPIEA-WBVHZDCISA-N 288.435 3.198 70 20 CGID CC(C)(C)c1nsc(Oc2cccnc2F)n1 159910116 AMMBHZFPMJSSGA-UHFFFAOYSA-N 253.302 3.162 70 20 CGID CCC[C@H](C)CC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 159550330 YBHCSAABCZXJIO-ZMSDIMECSA-N 291.435 3.484 70 20 CGID Cc1ccc(NC(=O)N(C)CCc2nccs2)c(F)c1 159974058 SLBKOBHKPSKNIW-UHFFFAOYSA-N 293.367 3.297 70 20 CGID C[C@H]1CC(=O)CC[C@H]1C(=O)N1C[C@H](c2ccccc2)C[C@@H]1C 159789607 WUHDSNIWZKACBM-KJGCVMFHSA-N 299.414 3.396 70 20 CGID O=C(N1CCCCCC1)N1CCc2ccccc2C1 160296270 UDIXURQTPHGAHE-UHFFFAOYSA-N 258.365 3.041 70 20 CGID O=C(NCC1(CO)CCCC1)c1csc2ccccc12 160318498 HJBJOSPLBHDJTJ-UHFFFAOYSA-N 289.400 3.184 70 20 CGID CCC(CC)NC(=O)NCCCCc1ccccc1 217305038 NIZVLPOQIMQBOT-UHFFFAOYSA-N 262.397 3.497 70 20 CGID CC(C)c1ccccc1OCc1nnc2n1CCCC2 217323334 SFZNOFNDUMTKFF-UHFFFAOYSA-N 271.364 3.317 70 20 CGID Nc1cc(F)cc(C(=O)OCc2ccccc2F)c1F 217924928 YWBWAIPVKKXUGM-UHFFFAOYSA-N 281.233 3.043 70 20 CGID CS[C@@H](C)CC(=O)NCCc1ccccc1Cl 161399282 ZWXFCOLESWRWLY-JTQLQIEISA-N 271.813 3.140 70 20 CGID CN(Cc1ccccn1)C(=O)c1cc(F)cc2cccnc12 161171374 GKGGEIKVRUBOPB-UHFFFAOYSA-N 295.317 3.041 70 20 CGID CC(C)CN1CCC(NC(=O)C(C)(C)C2CCCC2)CC1 161366881 OWSKKVRVTQEPKY-UHFFFAOYSA-N 294.483 3.439 70 20 CGID CCC(C)(C)NC(=O)[C@H]1C[C@@H]1c1sccc1C 160573278 IXRCQXPXASKRMR-QWRGUYRKSA-N 251.395 3.465 70 20 CGID CC[C@@H](NC(=O)c1ccccc1F)c1c(C)noc1C 160623509 DUFUJENQPOMWRL-CYBMUJFWSA-N 276.311 3.312 70 20 CGID COCCC1(CNc2nc(C(C)(C)C)ns2)CC1 160021688 JBHRLFVHNGAEIH-UHFFFAOYSA-N 269.414 3.064 70 20 CGID Cc1ccc(NC(=O)N[C@H](C)c2ccccc2)cn1 161411172 KGVYILNCTWDCDM-GFCCVEGCSA-N 255.321 3.273 70 20 CGID c1csc(-c2nc(CSc3ccncc3)no2)c1 160007852 KYVCGUDKYXZXOB-UHFFFAOYSA-N 275.358 3.485 70 20 CGID Cc1ccc(C)c(C(=O)Nc2nnc(-c3ccc(C)o3)[nH]2)c1 160224467 WQDPMTPUCUGDOE-UHFFFAOYSA-N 296.330 3.242 70 20 CGID FC(F)(F)c1cccnc1N[C@@H]1CCO[C@@H](C2CC2)C1 160356625 AQOBADPRMYLILQ-ZYHUDNBSSA-N 286.297 3.470 70 20 CGID O=C(Nc1nc2cc(Cl)ccc2s1)[C@H]1CCCCO1 160715730 STNZFRAWWUANBG-SNVBAGLBSA-N 296.779 3.457 70 20 CGID CCCC1(CN[C@H](C(=O)NC2CC2)c2ccccc2)CC1 160771791 LDJFGOPLTVXLOI-INIZCTEOSA-N 286.419 3.176 70 20 CGID CS[C@H](C)CC(=O)N[C@H](C)COc1cccc(C)c1 160846927 OHVOQWUHFDXLPS-CHWSQXEVSA-N 281.421 3.020 70 20 CGID O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)NC1CC1 160951394 FQMXIHCGIGEKHF-UHFFFAOYSA-N 296.374 3.109 70 20 CGID Cc1cc(C(=O)N(Cc2ccc(C)s2)C(C)C)ncn1 159815656 GTGRKCCLGUNVBM-UHFFFAOYSA-N 289.404 3.206 70 20 CGID C[C@@H](CNCc1cccc2c1NCCC2)N1CCCCC1 159386472 CYXXQZHOWCVOLN-HNNXBMFYSA-N 287.451 3.009 70 20 CGID Cc1cc(OC(=O)[C@@H]2CCCCO2)ccc1Cl 159585568 ADIMZBUONOZDRW-LBPRGKRZSA-N 254.713 3.123 70 20 CGID CC(C)c1ccc(-c2cc(S(=O)(=O)Cl)on2)cc1 521400453 MZGUARIVBKRCMX-UHFFFAOYSA-N 285.752 3.393 70 20 CGID C[C@@H](C1CC1)N(Cc1ccccc1)Cc1csnn1 159682252 JQJKLVVBMZQMRR-LBPRGKRZSA-N 273.405 3.339 70 20 CGID CCO[C@@H]1C[C@H](N[C@H](C)c2cccnc2)C12CCC2 160897925 KPEPYRNLGIQTJX-VHDGCEQUSA-N 260.381 3.080 70 20 CGID OCCN(Cc1ccccc1)Cc1csc(C2CC2)n1 161408601 JAIDGIRQUMJVBF-UHFFFAOYSA-N 288.416 3.015 70 20 CGID Cc1ccccc1[C@H](CC(C)C)NCC(=O)NC(C)C 161007935 OVBJZJATCYOURQ-INIZCTEOSA-N 276.424 3.196 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)c1cc(C(C)=O)cn1C 161283287 OQXAJYRUEOFABA-UKRRQHHQSA-N 290.407 3.269 70 20 CGID CCCN(CCC)C(=O)COc1ccc2[nH]ccc2c1 160045713 MIXFNZJFXUVZHJ-UHFFFAOYSA-N 274.364 3.195 70 20 CGID CC(C)n1cccc1C(=O)NC[C@H](c1ccccc1)N(C)C 160923126 JLOOFEZIBVNLDJ-QGZVFWFLSA-N 299.418 3.102 70 20 CGID CCN(CCCS(=O)(=O)C(C)C)c1cc(C)ccc1C 160954906 XWJUFKNAXLVDGX-UHFFFAOYSA-N 297.464 3.343 70 20 CGID O=C(NC1CC=CC1)C1(Cc2ccccc2)CCC1 160968877 GNBNLMKCVXZQJH-UHFFFAOYSA-N 255.361 3.234 70 20 CGID CCCCN1CCc2ccc(NC(=O)c3ccc[nH]3)cc21 160972638 PYDDZFDSGWHIHW-UHFFFAOYSA-N 283.375 3.430 70 20 CGID CC(C)Cn1ncc(C(=O)N[C@@H]2C=CCCC2)c1C1CC1 159862858 UOOXPTLPAWYGLI-CQSZACIVSA-N 287.407 3.255 70 20 CGID C[C@@H](NC[C@@H](C)N1CCc2sccc2C1)c1ccco1 159867353 WIRNREPQIQAGES-CHWSQXEVSA-N 290.432 3.439 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1C(=O)NCc1ccc2ccccc2c1 159780969 CFYBLFPHSKYWPK-UGSOOPFHSA-N 295.382 3.461 70 20 CGID CCC1(C(=O)Nc2cccc(S(=O)(=O)F)c2)CCCC1 788496228 YZXPGRUBTQAPPA-UHFFFAOYSA-N 299.367 3.254 70 20 CGID CCNCC1CCN(C(=O)[C@H]2[C@@H](C=C(C)C)C2(C)C)CC1 161015771 NSORJZIBHUDLPX-HZPDHXFCSA-N 292.467 3.073 70 20 CGID CC[C@@H](C)NC(=O)c1cccc(CN[C@@H](C)C2(C)CC2)c1 161117187 LFIYNVCVWHBCRE-KGLIPLIRSA-N 288.435 3.493 70 20 CGID O=C(Nc1ccc(F)cc1OCC1CC1)NC1CC=CC1 161181739 FRDPCVVRZRQTSQ-UHFFFAOYSA-N 290.338 3.455 70 20 CGID CCCCn1ncc(NC(=O)N2[C@H](C)CC[C@H]2C)c1C 160110229 HFYSKRLGLIRHRS-VXGBXAGGSA-N 278.400 3.396 70 20 CGID CCc1nc(CN[C@H](C)c2ccc3c(c2)CCCC3)n[nH]1 160277969 MEBYJQGIZDOFMC-GFCCVEGCSA-N 284.407 3.097 70 20 CGID FC(F)(F)c1ccc(OCCN[C@H]2CCSC2)cc1 160505674 KNFHFLGRBBMXBL-NSHDSACASA-N 291.338 3.179 70 20 CGID CC(C)c1cc(=O)n(Cc2cc(-c3ccccc3)no2)cn1 160885027 ATXOYSYSMWOPIF-UHFFFAOYSA-N 295.342 3.070 70 20 CGID CCc1ccc([C@H](C)CC(=O)N[C@H](CO)CC(C)C)cc1 160989974 QJNLYMGBMPYKHA-PBHICJAKSA-N 291.435 3.266 70 20 CGID CCCn1nccc1CNCCc1c[nH]c2ccccc12 159975911 ZGOVIJWHSHPQTC-UHFFFAOYSA-N 282.391 3.107 70 20 CGID C[C@@H]1Sc2ccccc2N(CC[C@@H]2CCOC2=O)[C@H]1C 161161632 KKEQVRQZBSPNLN-RWMBFGLXSA-N 291.416 3.329 70 20 CGID COc1ccc(NC(=O)C(C)(C)c2cccs2)cc1N 161291552 VPJCDUGPXVOEEX-UHFFFAOYSA-N 290.388 3.255 70 20 CGID C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc2[nH]ccc2c1 160038285 QEUBKFZWEVQIKH-STQMWFEESA-N 286.375 3.336 70 20 CGID CC(C)CC[C@H](NC(=O)CCNC(C)C)C(C)(C)C 160071950 MKXNVULNGVCDJL-AWEZNQCLSA-N 270.461 3.342 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)NCCSc1ccccc1 160122088 IDXNNSYOLQWVLS-ZFWWWQNUSA-N 263.406 3.331 70 20 CGID Cc1nnc(N[C@@H]2CCO[C@H](c3ccccc3)C2)s1 160534280 DSVUCCCNHMYZDG-OLZOCXBDSA-N 275.377 3.179 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@H]1CSCCc2ccccc21 160604045 TWFUEGLLNQATSB-PVAVHDDUSA-N 291.460 3.158 70 20 CGID CC1(C)C[C@@H](Nc2cc(C(F)(F)F)ccn2)CCO1 160677476 KVRWUOFVQHDKTA-JTQLQIEISA-N 274.286 3.470 70 20 CGID CN(C[C@H]1CCC[C@@H]1O)C(=O)NCCCCC(C)(C)C 160787124 JRGCXVMTAIGUHG-KGLIPLIRSA-N 284.444 3.005 70 20 CGID CC(C)CCSc1nnc(-c2ccccn2)n1C 159568289 MHZSOYCSPXCPJI-UHFFFAOYSA-N 262.382 3.015 70 20 CGID COC[C@H](NC(=O)c1ccc(Cl)cc1C)C(C)C 159579544 VRWMDXYYJXJRFS-ZDUSSCGKSA-N 269.772 3.049 70 20 CGID CN(CCOCC1CC1)C(=O)C1CCC(C)(C)CC1 161145804 NHIQIRRCVRYABC-UHFFFAOYSA-N 267.413 3.088 70 20 CGID CCCC1(CNC(=O)Nc2cc(C(=O)OC)cs2)CC1 161149958 WBQDAZIHCTTZBM-UHFFFAOYSA-N 296.392 3.237 70 20 CGID O=C(Nc1nccs1)N[C@H]1CCCc2sccc21 161175909 OMKURJXFKOCLNE-VIFPVBQESA-N 279.390 3.404 70 20 CGID CC(C)C[C@H](NC(=O)[C@H]1CCCCO1)c1ccccc1 160103663 NRNXHPAGFNOSEZ-JKSUJKDBSA-N 275.392 3.459 70 20 CGID O=C(CCC1CCC1)N[C@H]1CCOC2(CCCC2)C1 160149604 AJMMWOIUKDMLON-AWEZNQCLSA-N 265.397 3.175 70 20 CGID Cc1ccc(CC(=O)N[C@@H]2CCCc3sccc32)cn1 160222020 HTDYUOGESZEGHN-CQSZACIVSA-N 286.400 3.188 70 20 CGID Cc1cccc(C)c1CNc1ccc2c(c1)NC(=O)CO2 160411949 JURYHERJAAKLPA-UHFFFAOYSA-N 282.343 3.246 70 20 CGID CC1(C)C[C@H]1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 159831626 RCETUFBDAIGDRH-KBPBESRZSA-N 293.794 3.286 70 20 CGID CCCCn1ncc(NC(=O)NCc2cccs2)c1C 159836475 RDGQKBNNVAJPKU-UHFFFAOYSA-N 292.408 3.375 70 20 CGID Cc1nc2ccccn2c1CN1CCC[C@@H]1C1CCC1 159698420 UDVKHQVYNXVJGZ-OAHLLOKOSA-N 269.392 3.407 70 20 CGID Cc1ccccc1CNC(=O)N1CC[C@H](C)[C@@H](C)C1 159890651 TXKSLSPVOFRITM-JSGCOSHPSA-N 260.381 3.183 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)CSCc1ccccn1 159759309 FQFJPKFFPXNULT-OCCSQVGLSA-N 278.421 3.010 70 20 CGID CCC[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(C)cc2)CCO1 159951875 UYGMAGIXODDUMS-GOEBONIOSA-N 290.407 3.267 70 20 CGID O=C1[C@H](Sc2cccs2)CCCN1CC(F)(F)F 159596949 NOWPAJNWEORRGI-MRVPVSSYSA-N 295.351 3.394 70 20 CGID CCCn1nccc1CNC[C@@H](C)c1ccccc1 159983527 DTEXBDFRZFFVMZ-CQSZACIVSA-N 257.381 3.186 70 20 CGID O=S(=O)(Cl)C1c2ccccc2Oc2ccccc21 168431513 VOHBHNNPGMRMOM-UHFFFAOYSA-N 280.732 3.450 70 20 CGID CCCn1nc(C)c(C(=O)Nc2cccc(F)c2)c1C 161152600 CRQNOTOWKPNVTR-UHFFFAOYSA-N 275.327 3.301 70 20 CGID CC(C)(C)c1noc(CSCc2cscn2)n1 161256896 PRLPQBBILIWEDT-UHFFFAOYSA-N 269.395 3.257 70 20 CGID COc1ccc2nc(N(C)CC3CCOCC3)ccc2c1 161292697 YGXGSGARCXUGQO-UHFFFAOYSA-N 286.375 3.106 70 20 CGID Cc1ccc(NC(=O)N(C)CCOCc2ccccc2)cn1 161416188 NGBDDLPPNVPVOT-UHFFFAOYSA-N 299.374 3.071 70 20 CGID CCO[C@H](C)c1nccn1Cc1cc(-c2ccco2)on1 161470018 RIGRUJFOGRVIET-LLVKDONJSA-N 287.319 3.277 70 20 CGID CC[C@@H](CN[C@H]1CCN(C)[C@H](C)C1)Oc1ccccc1F 160305001 DBPAPNUZBTXZBM-ILXRZTDVSA-N 294.414 3.055 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1 160328598 ARVHUIBMKYBLJB-LBPRGKRZSA-N 291.391 3.056 70 20 CGID CC[C@H](N[C@@H](CN1CCCC1=O)c1ccccc1)C1CC1 160772204 ZPBDHNKZSDDLTN-IRXDYDNUSA-N 286.419 3.128 70 20 CGID C[C@@H]1C[C@@H](NCCOc2cccc3ccccc23)CCN1C 160811465 HWCOVEHGGDJEHN-WBVHZDCISA-N 298.430 3.291 70 20 CGID C[C@H](NCCOc1cccc2ccccc12)c1cnccn1 160812456 LYSOFHUJOHOWES-AWEZNQCLSA-N 293.370 3.359 70 20 CGID O=C(CCC1CCC1)N1CCc2c(F)cccc2C1 160912475 HDRSZHHMBOIWOR-UHFFFAOYSA-N 261.340 3.291 70 20 CGID CCCOC1(CNC(=O)CO[C@H](C)CC)CCCCC1 160950047 DRWKMQBKWWYETE-CQSZACIVSA-N 285.428 3.047 70 20 CGID CC[C@@H](CCO)NC(=O)CCCCCc1cccs1 159402084 PNUSWOCCHJAFPG-ZDUSSCGKSA-N 283.437 3.128 70 20 CGID CCc1noc(C)c1CNc1cc(C(=O)OC)ccc1F 159367819 MWMQQFOQWOAMHT-UHFFFAOYSA-N 292.310 3.083 70 20 CGID CCC1CCN(C(=O)c2cnn(CC(C)C)c2C)CC1 159576068 KPPSOJHFUAFGFJ-UHFFFAOYSA-N 277.412 3.110 70 20 CGID Cc1cc(C(=O)CN(C)[C@@H]2CCC[C@@H](C)C2)c(C)[nH]1 218587177 VQLKKYIMNCOAJR-BXUZGUMPSA-N 262.397 3.325 70 20 CGID CC(C)C1CCN(CCCN2CCCCC2)CC1 161262621 BKNMENVIGWJPPF-UHFFFAOYSA-N 252.446 3.230 70 20 CGID COC[C@@H](NC[C@H](C)COCc1ccccc1)C(C)C 161307801 XKGANAGHGNJJOF-DOTOQJQBSA-N 279.424 3.100 70 20 CGID C[C@H](NC[C@@H]1CCc2ccccc21)C1CCOCC1 161008469 NVQKNRUSFWQHBB-BBRMVZONSA-N 259.393 3.121 70 20 CGID Cc1cc(F)ccc1NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 161125353 DRVOPGQVGQFJSC-DZGCQCFKSA-N 292.354 3.213 70 20 CGID Cc1cc(C(=O)N[C@H](C)c2cc3ccccc3o2)ncn1 161280488 RUYXVVILZZAPAO-LLVKDONJSA-N 281.315 3.022 70 20 CGID CSC[C@@H](CCO)N[C@H](Cc1ccc(C)cc1)C(C)C 160394989 LJVICMQUHOVGNP-IAGOWNOFSA-N 295.492 3.266 70 20 CGID C[C@H](CNC(=O)CC[C@H](C)c1ccccc1)C[C@@H](C)O 160685085 NQILZUHXTMPYLC-SOUVJXGZSA-N 277.408 3.094 70 20 CGID O=C(Nc1cccc(F)n1)[C@H](c1ccccc1)C1CC1 160766553 QCBDGCVWZKGIME-OAHLLOKOSA-N 270.307 3.353 70 20 CGID CC(C)c1cc(C(=O)NCCCF)nn1-c1ccccc1 160988019 QRFQYPFRYDWUBP-UHFFFAOYSA-N 289.354 3.085 70 20 CGID Cc1ccccc1[C@@H](C)NCCCOCC1CCOCC1 159667403 MRALDQIZKUMVBF-MRXNPFEDSA-N 291.435 3.479 70 20 CGID C[C@H](Cc1cccc(Cl)c1)C(=O)NCCc1ccco1 159483695 UXIWFHPQIGPKIN-GFCCVEGCSA-N 291.778 3.471 70 20 CGID CC[C@H](NCCOC[C@@H]1CCCO1)c1ccc(F)cc1 160931581 GJDTVMSJFDOIQE-HOTGVXAUSA-N 281.371 3.062 70 20 CGID COC(=O)C[C@@H](C)SCc1noc(C2CCCCC2)n1 159813740 RPCKLYAPOJQLSW-SNVBAGLBSA-N 298.408 3.302 70 20 CGID Brc1ccc2c(c1)N(Cc1ccco1)CCO2 217253693 ZQLZGFFFZLPRIR-UHFFFAOYSA-N 294.148 3.441 70 20 CGID Cc1cc(F)ccc1CCNC(=O)NCC1(C2CC2)CC1 160038422 QSOIHOXODZQBRR-UHFFFAOYSA-N 290.382 3.166 70 20 CGID C[C@@H]1Cc2ccc(F)cc2[C@@H]1NC[C@@H]1CCCC[C@@H]1O 160659242 LEVGUHRZOSMECS-NYUZSIGZSA-N 277.383 3.200 70 20 CGID C[C@@H]1CN(C)[C@H](C)C[C@H]1NC[C@@H]1CCc2ccccc21 160972632 DGQHNIJNJANJDM-AHEZYBDSSA-N 272.436 3.035 70 20 CGID C[C@H]1CC(=O)CC[C@@H]1c1nc(-c2ccsc2)no1 160992887 WZMSIAXSNAFNGK-KWQFWETISA-N 262.334 3.271 70 20 CGID CCC(C)(CC)C(=O)NCc1cc(F)cc(OC)c1 159416429 LQNCHTOFBBVOEO-UHFFFAOYSA-N 267.344 3.277 70 20 CGID CSc1ccc(NC(=O)NCCc2cscn2)cc1 159366492 BJRUNNDKSMOCMF-UHFFFAOYSA-N 293.417 3.229 70 20 CGID CC[C@@H](C)[C@H](C(=O)N(CC)CCCO)c1ccccc1 160485250 JNTNXQLSTDPCBT-ZBFHGGJFSA-N 277.408 3.047 70 20 CGID CC(C)c1cc(C(=O)NC2[C@H](C)CCC[C@H]2C)n[nH]1 217234742 HIRHWRNKIXFBBM-GHMZBOCLSA-N 263.385 3.088 70 20 CGID CO[C@@H]1CCCC[C@@H]1N[C@@H](C)c1ccc2c(c1)OCCO2 218183767 AVCJGYKELSGNES-AEGPPILISA-N 291.391 3.066 70 20 CGID C=CCCC1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CC1 460093389 OPTJEFSJEFRNSV-UHFFFAOYSA-N 297.351 3.030 70 20 CGID O=C(c1ccccc1Br)N1[C@H]2C=CC[C@H]1CC2 218739348 WAWLZXXHJQLGFI-QWRGUYRKSA-N 292.176 3.382 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1ncoc1C 161191344 PDVRNFOXGKMMLC-RYUDHWBXSA-N 250.342 3.024 70 20 CGID CC[C@H](S[C@@H](CC)c1ccc(F)cc1F)C(N)=O 161363290 LLTQUXLLAQCAMQ-RYUDHWBXSA-N 273.348 3.413 70 20 CGID COc1ccc2cc(CNC(=O)[C@@H]3CCCCO3)ccc2c1 160470113 ODZGAIGKAHNREY-KRWDZBQOSA-N 299.370 3.034 70 20 CGID CC[C@@H](NC(=O)c1ccoc1C)c1c(C)noc1C 160486448 QULKXSCLXYWSEZ-GFCCVEGCSA-N 262.309 3.074 70 20 CGID CCc1noc(C)c1CSCC(=O)N1CCCC[C@H]1C 159982868 NJWBTGXKQHMRSC-LLVKDONJSA-N 296.436 3.180 70 20 CGID Cc1cc(N[C@@H](C)c2ccc(F)c(F)c2)nn1C 159595222 BTYNYCCQBMQEHQ-VIFPVBQESA-N 251.280 3.180 70 20 CGID CC(C)(N)CNC(=O)C1(c2ccc(Cl)cc2)CCCC1 159992871 MATDMCUZOCYVTI-UHFFFAOYSA-N 294.826 3.005 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1ccc(OC)c(F)c1 160080637 IBFWJDOTCORTIG-STQMWFEESA-N 282.403 3.215 70 20 CGID CO[C@@H](C(=O)N1CCC[C@H]1c1ccncc1)c1ccccc1 161302688 QTXLBAAZMIAHTC-DLBZAZTESA-N 296.370 3.133 70 20 CGID CCOCCCC(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C 161387640 ZWPZUDBHBFEHLU-UHFFFAOYSA-N 291.351 3.042 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CC2(C)C)o1 161414572 VSRARNCKLKWJFQ-OLZOCXBDSA-N 277.364 3.136 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)NCC1(C2CC2)CC1 160237315 VPYMDTXAOSIUBL-WCQYABFASA-N 250.386 3.055 70 20 CGID CSC[C@H](CCO)N[C@H](Cc1cccc(C)c1)C1CC1 160393965 VMADDRGWTZAAHE-DLBZAZTESA-N 293.476 3.020 70 20 CGID CC[C@@H](NCCC(=O)OC(C)C)c1ccc(F)cc1F 160693395 KZQORHVPJPKGTH-CQSZACIVSA-N 285.334 3.347 70 20 CGID Cn1c(C(=O)NC2CC=CC2)c(Cl)c2ccccc21 160849296 NHDRYTLVFMJKSL-UHFFFAOYSA-N 274.751 3.280 70 20 CGID CC[C@H](C)[C@@H](C)NC(=O)N1CCC(CCCN(C)C)CC1 160932031 KYWHOEMYZXTCMS-LSDHHAIUSA-N 297.487 3.184 70 20 CGID CC[C@H](NC(=O)Nc1ccc(C)c(F)c1)[C@@H]1CCCO1 159418138 MKZFSGPPEKXGPA-KBPBESRZSA-N 280.343 3.213 70 20 CGID CCOc1ccccc1N(C)Cc1nc(CC(C)C)no1 159424619 SSRXEFXRFWPYEB-UHFFFAOYSA-N 289.379 3.303 70 20 CGID COC[C@@H](NC(=O)Nc1cccc(C(F)F)c1)C1CC1 159822696 AOHYBQUCCGRECX-GFCCVEGCSA-N 284.306 3.171 70 20 CGID CCc1ccc([C@@H](CNC(=O)C2=CCCC2)N(C)C)cc1 159653144 VTWZDDYMENGFJM-QGZVFWFLSA-N 286.419 3.078 70 20 CGID CCc1nnc([C@H](C)Nc2ccn(CCC(C)C)n2)o1 159941630 CRNZOVWQJAMGKX-NSHDSACASA-N 277.372 3.048 70 20 CGID CCSCC[C@H](C)NC[C@@H](O)c1c(F)cccc1F 160086534 LPZMHZFVSOGJOB-GXFFZTMASA-N 289.391 3.120 70 20 CGID CC[C@H](COC)NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1 217237746 MIGZTDIWULIQKR-MGPQQGTHSA-N 269.429 3.380 70 20 CGID FC(F)(F)c1ccccc1CN[C@@H]1CCN2CCCC[C@@H]12 217643561 NVQLGXPKROHVPR-CABCVRRESA-N 298.352 3.422 70 20 CGID Cc1ccc(Cl)cc1S(=O)(=O)N1[C@H]2C=CC[C@H]1CC2 218758793 XSQRWFMRGZFVTA-STQMWFEESA-N 297.807 3.130 70 20 CGID CC[C@@H](c1ccncc1)N(CC)C(=O)NCC(C)C 160829156 VFIZMOONFVUUHE-AWEZNQCLSA-N 263.385 3.220 70 20 CGID O=C(C1CC1)N1CC[C@H](c2cccc(Br)c2)C1 217253816 DVFQQVDHNPRIEX-LBPRGKRZSA-N 294.192 3.175 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cscn1 161098335 XZUQOTZWXZXLPD-PWSUYJOCSA-N 252.383 3.184 70 20 CGID Cc1nc2c(s1)[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)CCC2 161103247 JFIRFARKVNFTQW-YDHLFZDLSA-N 293.480 3.291 70 20 CGID CCN1CCCC[C@H]1CN[C@@H](C)c1cccs1 161170608 WGUMFTYVFWNSOQ-STQMWFEESA-N 252.427 3.273 70 20 CGID Cc1ccccc1C(=O)N[C@H]1CCOC2(CCCC2)C1 160050142 UYKCZQMJRXYNSE-AWEZNQCLSA-N 273.376 3.217 70 20 CGID CCCn1nc(C)c([C@@H]2NC(=O)c3c(C)cccc3N2)c1C 160148559 JNIVBLZBNVAPLJ-INIZCTEOSA-N 298.390 3.072 70 20 CGID Cc1ccc(-c2nnc(NC(=O)c3ccc(C)c(C)c3)[nH]2)o1 160382371 YWFDHJMHTCRMBT-UHFFFAOYSA-N 296.330 3.242 70 20 CGID CCc1nc(CN[C@@H](c2ccccc2C)C(C)C)n[nH]1 160425422 ZFQGOORHHDXSEY-MRXNPFEDSA-N 272.396 3.162 70 20 CGID CCSCc1cccc(NC(=O)C[C@H]2CCCN2)c1 160425510 XZWLTFIALMZXMF-CYBMUJFWSA-N 278.421 3.020 70 20 CGID O=C([C@H]1CCCCO1)N1CCC[C@H]1c1ccc(F)cc1 160622518 LHFCZRLRQIVOEP-LSDHHAIUSA-N 277.339 3.058 70 20 CGID CCCCO[C@H](C)C(=O)OCc1nc(C)sc1C 160761723 NSDUEMOPOZFUHG-SECBINFHSA-N 271.382 3.008 70 20 CGID Cc1cc(C(=O)NC(C)(C)c2nccs2)oc1C 160940400 WNZIRADADCSTQP-UHFFFAOYSA-N 264.350 3.018 70 20 CGID CCCCn1ncc(NC(=O)N[C@@H]2CCC[C@@H]2C)c1C 159800992 SFHVANRKEOXCMM-WCQYABFASA-N 278.400 3.302 70 20 CGID CSc1ccccc1NC(=O)N(C)[C@@H]1CCSC1 159431585 ZGMZVBFJIUESKI-SNVBAGLBSA-N 282.434 3.378 70 20 CGID CC(C)n1cc([C@@H](C)NC2CC(C)(C)NC(C)(C)C2)cn1 159633725 CLVXDNKQBNQJFG-CYBMUJFWSA-N 292.471 3.424 70 20 CGID COc1ccc(CN(C)Cc2ccccc2NC(C)=O)cc1 159869792 PLKZOQSGGCZDFK-UHFFFAOYSA-N 298.386 3.286 70 20 CGID CCC(CC)CC(=O)N[C@@H]1CCOC2(CCCC2)C1 159911643 GJEROXQECUBCEQ-CQSZACIVSA-N 267.413 3.421 70 20 CGID C[C@H](CCCO)Nc1ncc(Cl)cc1Br 159613704 GPFHCVIXEJFYKG-SSDOTTSWSA-N 293.592 3.070 70 20 CGID CC(C)(C)C(=O)N1CCC(CN2CCC3(CCC3)C2)CC1 160150435 KFYIVFNBXHNSDN-UHFFFAOYSA-N 292.467 3.147 70 20 CGID Cc1ccc(CCC(=O)N(C)Cc2cccn2C)c(C)c1 160613154 IRQCONBEQHHMDB-UHFFFAOYSA-N 284.403 3.233 70 20 CGID CC(C)CSCCCNC(=O)[C@@H]1C[C@H]1c1cccnc1 160668745 IRMRHQBCEHNZDC-LSDHHAIUSA-N 292.448 3.081 70 20 CGID CC[C@@H](NCCCNC(=O)C(C)C)c1ccc(F)cc1F 159982628 XMLFUDFFKPNCMT-OAHLLOKOSA-N 298.377 3.168 70 20 CGID CC1(C)CC(Nc2ccc(C(N)=O)cn2)CC(C)(C)C1 159387572 SKUYDQFXSUCMJP-UHFFFAOYSA-N 275.396 3.197 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1nc(C(C)(C)C)ns1 160041284 MRCSBVXRMLVDEO-VIFPVBQESA-N 271.430 3.045 70 20 CGID CCOCCCN(Cc1cccc(O)c1)CC1CC1 159914393 OHPTZBYQIDUUMM-UHFFFAOYSA-N 263.381 3.031 70 20 CGID COCCCCN(Cc1ccccc1)C(=O)[C@@H]1CC1(C)C 161092286 DYTYMFDMHGFNQC-INIZCTEOSA-N 289.419 3.488 70 20 CGID CCOCc1cccc(NC2CCC(NC(C)=O)CC2)c1 161167309 GCLPBPQQTZZCSM-UHFFFAOYSA-N 290.407 3.082 70 20 CGID CC(C)(C)n1cc(NC(=O)N(CC2CC2)CC2CC2)cn1 161290574 DDINXCVVOKFNCJ-UHFFFAOYSA-N 290.411 3.292 70 20 CGID Cc1cc(C)c2c(c1)[C@H](NC1CCN(C)CC1)CCCO2 161507572 GMOJZGXBYXOOJS-QGZVFWFLSA-N 288.435 3.201 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)NCCc1nc2ccccc2s1 160146498 LVJCTSCIXARCHD-BZNIZROVSA-N 288.416 3.391 70 20 CGID CC[C@H](C)OCC(=O)Nc1cccc(Cl)c1OC 160807058 QVFLBCTWYKMMIF-VIFPVBQESA-N 271.744 3.102 70 20 CGID CC(C)C[C@@H](CO)NC(=O)CCc1ccc2ccccc2c1 160814645 AAXOGWIVDFKJAP-SFHVURJKSA-N 299.414 3.296 70 20 CGID CN(C)Cc1ccc(CN[C@@H]2CC(C)(C)OC2(C)C)cc1 160892669 HZLZQKCUUBJJGQ-MRXNPFEDSA-N 290.451 3.184 70 20 CGID CC1(C)C[C@H](NC(=O)NCc2cccc(Cl)c2)CCO1 160989838 MVCBZKSWIRHSKZ-CYBMUJFWSA-N 296.798 3.097 70 20 CGID CC[C@@H](NC(=O)Nc1cc(C)ccc1OC)[C@@H]1CCCO1 159412794 CJZYTSZICAQIHQ-DOMZBBRYSA-N 292.379 3.083 70 20 CGID CC(C)n1ccnc1CN(C)Cc1ccc(F)c(F)c1 160752673 QCUFEFORCLAQTF-UHFFFAOYSA-N 279.334 3.374 70 20 CGID O=S(=O)(Cl)CCCOc1cccc2ccccc12 100495514 IOSUJCXANHTLLX-UHFFFAOYSA-N 284.764 3.177 70 20 CGID C[C@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H](N)C1 217485410 OBOWQDQHJUIGLS-ZYHUDNBSSA-N 288.313 3.069 70 20 CGID CCc1cnc(CNc2ccc(C(F)(F)F)nn2)s1 218046943 QTFKLFUOKWHBSE-UHFFFAOYSA-N 288.298 3.126 70 20 CGID Cc1nc(Cl)cc(NC[C@H]2CCCN(CC(C)C)C2)n1 161291085 PSERDIRPCILGCL-CYBMUJFWSA-N 296.846 3.218 70 20 CGID Cc1ccc(F)c(OCC(=O)N2CCC[C@H]3CCC[C@H]32)c1 161329173 KLLKQHFISHGRJH-UKRRQHHQSA-N 291.366 3.304 70 20 CGID CCCOc1cc(C)ccc1NC(=O)N[C@]1(C)CCOC1 161374287 NVPIAOIRSTZRSF-MRXNPFEDSA-N 292.379 3.084 70 20 CGID FC(F)(F)c1ccnc(N[C@H]2CCO[C@H](C3CC3)C2)c1 160332529 AISKDABCEULTFS-RYUDHWBXSA-N 286.297 3.470 70 20 CGID Cc1c(NC(=O)N(C)CCC2CC2)cnn1-c1ccccc1 160617113 SWOBJGHQJODCHG-UHFFFAOYSA-N 298.390 3.445 70 20 CGID CC[C@@H](NC[C@@H]1CCCO1)c1ccc(F)cc1F 160652166 XRUSSEDDCHQNIE-SMDDNHRTSA-N 255.308 3.185 70 20 CGID CN(CCC1CC1)CC1CCN(C(=O)C(C)(C)C)CC1 160928646 BNINTDZPOGRKRL-UHFFFAOYSA-N 280.456 3.003 70 20 CGID CCC[C@H](C(=O)NCc1ccccc1OC)C(C)C 160934758 KMWMYMAVGNVMPC-AWEZNQCLSA-N 263.381 3.384 70 20 CGID O=C(NCC(F)F)c1ccc(CCC(F)(F)F)cc1 159416988 JAOURHJGNSQHGJ-UHFFFAOYSA-N 281.224 3.176 70 20 CGID CCO[C@H](C)C(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 159815857 MWERCXUOTZSNHT-PBHICJAKSA-N 298.386 3.021 70 20 CGID COC(=O)c1ccc(CSC[C@@H]2CCCCO2)s1 159676615 SMRCHKZJHTZWLC-JTQLQIEISA-N 286.418 3.337 70 20 CGID COc1ccccc1[C@@H]1C[C@H]1C(=O)NCC1(C2CC2)CC1 159883561 OBJQZBFJAVLOGN-LSDHHAIUSA-N 285.387 3.105 70 20 CGID CN(C(=O)[C@@H]1CCCCO1)c1ccc2ccccc2c1 159908509 ANPUORHLAGEHGO-INIZCTEOSA-N 269.344 3.372 70 20 CGID CCc1ncsc1C(=O)N[C@H](CC)c1c(C)noc1C 159993420 RMEBHKBZXVZGGR-SNVBAGLBSA-N 293.392 3.191 70 20 CGID CC1(C)C[C@H](NCc2c[nH]nc2-c2cccs2)CCO1 160509838 WDIVTUVDHUWMRG-GFCCVEGCSA-N 291.420 3.185 70 20 CGID CCCCCNC(=O)NCc1ccc(Cl)cc1 217315286 QBFFBFWKDBQXQT-UHFFFAOYSA-N 254.761 3.329 70 20 CGID COc1cc(CN2CCC[C@H](C)[C@@H]2C)cc(OC)c1O 217836841 XWPQQYPVBBNLGR-RYUDHWBXSA-N 279.380 3.030 70 20 CGID CCN1CCCC[C@@H]1CN[C@@H](C)c1ccc(OC)cc1 161203040 XQXJVAURNSJSGT-GOEBONIOSA-N 276.424 3.220 70 20 CGID Cc1cc(C)cc(OCCN[C@H](C)C2CCN(C)CC2)c1 161255899 DTXXRAISRPWMFE-MRXNPFEDSA-N 290.451 3.002 70 20 CGID O=C(CCc1ccccc1F)NCC1(C2CC2)CC1 160059234 WFOASOOWPTXIFJ-UHFFFAOYSA-N 261.340 3.065 70 20 CGID Cc1cccc([C@@H]2CCCN2CCn2ccnc2)c1 159769677 QCTJTFGOBSFXSR-INIZCTEOSA-N 255.365 3.029 70 20 CGID CCOC(CCN[C@@H](C)c1ccc(F)cc1)OCC 159862836 RHQOHXWTGYQPIB-LBPRGKRZSA-N 269.360 3.266 70 20 CGID O=C(Nc1ccc2c(c1)OC(F)(F)O2)N1CCCCC1 160328038 SPFCXTPYCGEQQY-UHFFFAOYSA-N 284.262 3.026 70 20 CGID Cc1cccc(C(=O)N[C@@H](CO)c2ccccc2)c1Cl 160380384 SXHDBCYVLOSNOB-AWEZNQCLSA-N 289.762 3.112 70 20 CGID COC(=O)c1ccc(OC(=O)c2ccc(F)c(C)c2)cc1 216830500 WQVWJVUSQZMCOG-UHFFFAOYSA-N 288.274 3.140 70 20 CGID CCC[C@H](C)CC(=O)N[C@H]1CCOC2(CCCC2)C1 159662546 LAPFKBDZJBRPRF-KBPBESRZSA-N 267.413 3.421 70 20 CGID FC(F)Oc1ccccc1OCc1nccs1 161330300 WMIGSILMFHOJBF-UHFFFAOYSA-N 257.261 3.324 70 20 CGID CCO[C@@H](CC)C(=O)N1CCc2c(Cl)cccc21 161476501 AJJDLNCHXNTCNU-ZDUSSCGKSA-N 267.756 3.044 70 20 CGID O=C(COc1ccc2[nH]ccc2c1)NCc1ccccc1F 160022249 YAELPBJZVGGMLS-UHFFFAOYSA-N 298.317 3.002 70 20 CGID CC[C@@H](C)[C@H](C)NCc1ccccc1CN1CCOCC1 160428078 ATXFYZGWUQLBEJ-CVEARBPZSA-N 290.451 3.043 70 20 CGID CC[C@@H](COC)NCC1(Sc2ccccc2)CC1 160505985 ZBEMYIHVEHXWNJ-ZDUSSCGKSA-N 265.422 3.326 70 20 CGID Cc1cc(NC(=O)NC2C[C@H](C)O[C@@H](C)C2)ccc1F 160575137 FCQURYLDMMRANT-QWRGUYRKSA-N 280.343 3.212 70 20 CGID Cc1cccc([C@H]2CCCN2C(=O)C[C@@H]2CCCN2)c1C 160723182 RGETZEVAEQYHSL-DOTOQJQBSA-N 286.419 3.109 70 20 CGID Cc1cccc([C@@H](C)NC(=O)[C@@H](N)Cc2ccccc2)c1C 160833835 GUQUXLVFFVUZTM-QAPCUYQASA-N 296.414 3.051 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cc(C(=O)OC)c(F)cc1F 160845619 BTFGUUUVOVWSMT-BJOHPYRUSA-N 297.301 3.126 70 20 CGID Cc1ccc(NC(=O)NCC(C)(C)[C@H](O)C(C)C)cc1F 160856828 FQUALPPBLZOBFR-CQSZACIVSA-N 296.386 3.299 70 20 CGID CC[C@H](NCCOC[C@H]1CCCO1)c1ccc(F)cc1F 160931338 LOFGHUJZBDEBGO-CJNGLKHVSA-N 299.361 3.201 70 20 CGID CC[C@H](C(=O)NC[C@@]1(C)CCCO1)c1ccc(F)cc1 160946835 HUWFJOMCTKEQSK-GOEBONIOSA-N 279.355 3.005 70 20 CGID Cc1cc(=O)n(C)cc1NC(=O)C[C@@H]1CCCCC1(C)C 159865408 QJEWAXHDNRJPDR-ZDUSSCGKSA-N 290.407 3.239 70 20 CGID C[C@@H]1CCC[C@@H](C(=O)N[C@@H]2CCOC3(CCCC3)C2)C1 159934348 DOPWHOVJFZIXHO-RBSFLKMASA-N 279.424 3.421 70 20 CGID Cc1c(F)cccc1NC(=O)N(C)CCC1CC1 159562888 YXKZFDQYBLVSBN-UHFFFAOYSA-N 250.317 3.398 70 20 CGID COC[C@H](NCc1csc(-c2ccccc2)n1)C1CC1 161495876 QGWYEWNYWDCUSU-HNNXBMFYSA-N 288.416 3.325 70 20 CGID C[C@H]1CCN(C(=O)CCc2ccc(F)cc2F)[C@H]1C 160711566 NTRRHBSJMKJRML-QWRGUYRKSA-N 267.319 3.154 70 20 CGID CCCCN(C)C(=O)Cc1cccc(OCCC)c1 160757699 AUJBBXGMYIMVGL-UHFFFAOYSA-N 263.381 3.276 70 20 CGID CCN(Cc1ccccc1Cl)C(=O)[C@@H]1CCCCO1 161231194 RFBDGGNEAAMCLD-AWEZNQCLSA-N 281.783 3.258 70 20 CGID CCO[C@H]1C[C@H](N[C@@H](CC)c2cnn(C)c2)C1(CC)CC 161291808 RUYHKXVJQVEZOE-JYJNAYRXSA-N 293.455 3.445 70 20 CGID CS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(C)nc2)C1 161331959 SVOMEQMIQTYCGW-YPMHNXCESA-N 279.409 3.186 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCc3cc(F)ccc32)cn1 161377865 IEXPBEXMYBMVBH-HNNXBMFYSA-N 285.322 3.338 70 20 CGID Cc1ccc(Cn2nc(C3CC3)nc2C2CC2)cc1 161473143 GQGFEOUYYYYWIK-UHFFFAOYSA-N 253.349 3.390 70 20 CGID Cc1ccc(CN(C(=O)c2ccc(CN)o2)C2CC2)cc1C 160549662 QIFLRSOUSYKNJE-UHFFFAOYSA-N 298.386 3.160 70 20 CGID CC(C)[C@H]1OCC[C@H]1CNc1nc(C(C)(C)C)ns1 159838971 IORAEQFRHMWXEW-WDEREUQCSA-N 283.441 3.309 70 20 CGID Cc1cc(N[C@H](C)c2cc(F)ccc2F)nn1C 159650765 CVSCZCJEUPYMIG-SECBINFHSA-N 251.280 3.180 70 20 CGID Cc1ccc(Cl)cc1C(=O)Nc1ccc(CCO)cc1 160377419 VHNGAXVSXXRHEY-UHFFFAOYSA-N 289.762 3.436 70 20 CGID CCCN(CC(=O)N(C)[C@@H]1CCCC[C@@H]1C)CC1CC1 217200412 JEMCQWUWHDNCMA-GOEBONIOSA-N 280.456 3.146 70 20 CGID CC[C@H](C)[C@H](C(=O)N1CCC[C@@H](CN)C1)c1ccccc1 217535034 YDPPUILLVGVSHU-ZOBUZTSGSA-N 288.435 3.014 70 20 CGID CC[C@H](CNC(=O)NOCc1cccnc1)c1ccccc1 161019999 XANJBQXBSFQXTD-OAHLLOKOSA-N 299.374 3.006 70 20 CGID CC(C)c1ccc(C(=O)N[C@H](C)Cc2ccc(O)cc2)cn1 161029402 FHDMDVUSATYTNR-CYBMUJFWSA-N 298.386 3.272 70 20 CGID CCc1noc(C)c1CSCCC(=O)NC1CCCC1 160023654 VOBQJGLOGXEFDV-UHFFFAOYSA-N 296.436 3.228 70 20 CGID CCc1nc(C)c([C@@H](C)NCCN(C)[C@@H](C)CC)s1 160063623 BEJHYBTZCUTQLF-NWDGAFQWSA-N 283.485 3.395 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1cc(OC)ccc1OC 160066318 SDCMAFMOIBQSFA-KGLIPLIRSA-N 294.439 3.085 70 20 CGID CCOCCCCNC(=O)c1cnn(C(CC)CC)c1C 160303964 XPVFHWDHBQPTKM-UHFFFAOYSA-N 295.427 3.099 70 20 CGID COc1ccc(C[C@H](C)C(=O)Nc2cccc(F)n2)cc1 160822685 MWBUYCCEHYEIIN-NSHDSACASA-N 288.322 3.047 70 20 CGID CC(C)c1cc(=O)n(Cc2ccc(OC(F)F)cc2)cn1 160918705 NXIJELWDIKDCJG-UHFFFAOYSA-N 294.301 3.016 70 20 CGID Cc1ncc([C@@H](C)NCc2ccc(C)s2)c(C)n1 160920745 BBOFMLSVXWXNCG-SNVBAGLBSA-N 261.394 3.314 70 20 CGID Cc1ccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c(C)c1 160934182 NAEMHJUGDLDBRK-HOCLYGCPSA-N 288.391 3.383 70 20 CGID C[C@@H](CC(=O)c1cccs1)NC(=O)C1CCCC1 160957483 SWPCRKWFMAUKRT-JTQLQIEISA-N 265.378 3.016 70 20 CGID C[C@H]1CC(C)(C)CC[C@H]1NC(=O)NC1C[C@@H](C)O[C@H](C)C1 159644655 YTXZIZJPNNANER-KYEXWDHISA-N 296.455 3.456 70 20 CGID Cc1cccc(C)c1NC(=O)N(C)[C@H]1CCSC1 159484107 INMBHOCXYANKPE-LBPRGKRZSA-N 264.394 3.273 70 20 CGID CS[C@H](C)CNC(=O)NCC(C)(C)CC(C)C 159516193 BOYJBDHUIRMEMW-LLVKDONJSA-N 260.447 3.109 70 20 CGID CC(C)(C)c1nsc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)n1 160102511 WSRFLGZQBPLAKY-MXWKQRLJSA-N 293.436 3.205 70 20 CGID CCCc1cc(C(=O)NCC2(CO)CCCC2)sc1C 160318778 VJGQXCRIKAVCQJ-UHFFFAOYSA-N 295.448 3.292 70 20 CGID CCc1ccc(CN(C)Cc2ccc(OC)cc2)o1 159859691 ASHDCVKDEFCZLS-UHFFFAOYSA-N 259.349 3.483 70 20 CGID Cc1ccc(NCc2nnc3n2CCCC3)cc1Cl 217317388 NDGJDPNBTFKKSV-UHFFFAOYSA-N 276.771 3.188 70 20 CGID CCc1ncnc(NC[C@@H](C)c2ccccc2)c1F 217957858 JOKRLHDXVKHAGP-LLVKDONJSA-N 259.328 3.394 70 20 CGID CCCC(O)(CCC)CC(=O)N1CCC[C@H]1C1CCC1 161364155 JSIXVQUEHDIMGR-HNNXBMFYSA-N 281.440 3.499 70 20 CGID C[C@@H](NC(=O)Nc1ccn(Cc2ccccc2)n1)C1CCC1 161396116 YQPDMCUVAQSXKP-CYBMUJFWSA-N 298.390 3.242 70 20 CGID C[C@H](NCCN(C)Cc1ccc(F)cc1)C1(C)CC1 160137052 VORVMHJJAZYWCS-ZDUSSCGKSA-N 264.388 3.036 70 20 CGID COc1ccc(OC(C)C)c(NC(=O)NC2CC=CC2)c1 160290287 CDGSLFVIGQPDET-UHFFFAOYSA-N 290.363 3.323 70 20 CGID C[C@H]1CCN(C(=O)Nc2cnc(C(C)(C)C)nc2)C[C@H]1C 160383069 ICKBBNAONXQHOU-NWDGAFQWSA-N 290.411 3.284 70 20 CGID CC1(C)C[C@@H](NCc2c(Cl)nc3ccccn23)CCO1 160432634 LUACBMQTYBMZEW-NSHDSACASA-N 293.798 3.035 70 20 CGID Cc1ccc(NC(=O)Nc2ccn(CC(F)(F)F)n2)cc1 160478539 FHRMMQAHIWFZFZ-UHFFFAOYSA-N 298.268 3.398 70 20 CGID Cc1ncc(CN[C@@H]2CCOC(C)(C)C2)n1-c1ccccc1 160528317 YWRNETGYBYIWNZ-OAHLLOKOSA-N 299.418 3.228 70 20 CGID CCOCCC1(C(=O)N(C)Cc2cccc(F)c2)CCC1 160573895 BHMBZOKMMMAZTJ-UHFFFAOYSA-N 293.382 3.381 70 20 CGID CCc1ccc([C@@H](CO)NC[C@@H]2CC=CCC2)cc1 160766783 APCRQXJFFRCBDP-NVXWUHKLSA-N 259.393 3.228 70 20 CGID Cc1noc(C)c1N(C)C(=O)C1CCC(C)(C)CC1 160955109 RGWDRVOVOLISTK-UHFFFAOYSA-N 264.369 3.471 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCCc1cccc(Cl)c1 159839178 FLIIAIFRNYFMJC-UKRRQHHQSA-N 265.784 3.435 70 20 CGID Cc1cccc2nc(CNC(=O)[C@H](C)c3cccs3)cn12 159656765 VPPNQLJUKLTSOR-GFCCVEGCSA-N 299.399 3.124 70 20 CGID COc1cccc(Cl)c1CC(=O)N(C)CC1CCC1 159944788 VOVXZAOBSQWXAG-UHFFFAOYSA-N 281.783 3.150 70 20 CGID CCOc1ccccc1N(C)Cc1noc(C(C)(C)C)n1 159381153 RXIRFYRIWYMJCO-UHFFFAOYSA-N 289.379 3.402 70 20 CGID Cc1csc(-c2cccc(C(=O)Nc3cn[nH]c3)c2)n1 159771975 SKUHCWZZSTWBBJ-UHFFFAOYSA-N 284.344 3.094 70 20 CGID C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1C=CCCC1 159789893 HAWSPGXVMSZQNE-ZFWWWQNUSA-N 288.391 3.073 70 20 CGID CC[C@@H](Nc1ccc2oc(C(C)C)nc2c1)C(=O)OC 159528188 UQPQNRPHTMYGED-LLVKDONJSA-N 276.336 3.315 70 20 CGID C/C=C/COC(=O)CCSc1ccc(F)cc1 217394431 BBISPQZWBCEMMH-NSCUHMNNSA-N 254.326 3.427 70 20 CGID Cc1ccc(C)c([C@H](C)NCCCNC(=O)C(C)C)c1 159979164 ZGMOIJMEJLUROC-HNNXBMFYSA-N 276.424 3.116 70 20 CGID CCc1ncnc(N[C@H](C)c2cccs2)c1F 217957633 FVIGUYFIMKHNEL-MRVPVSSYSA-N 251.330 3.413 70 20 CGID CC[C@@H](NC(=O)[C@@H]1CCCCO1)c1cccc(Cl)c1 161066291 YFROOYHKBWAKPS-KGLIPLIRSA-N 281.783 3.476 70 20 CGID Cc1ccc([C@H](C)NC(=O)NCc2ccccc2CO)cc1 161117902 DKVJBGLYZGPFIT-AWEZNQCLSA-N 298.386 3.048 70 20 CGID CC[C@H]1CCCC[C@@H]1NCc1cnn(C)c1C(F)(F)F 161433101 KONUQQJQHLLILA-JQWIXIFHSA-N 289.345 3.497 70 20 CGID Cc1nc(COC(=O)c2ccc(Cl)cn2)c(C)s1 161478461 XVJUYXRAJIVYSF-UHFFFAOYSA-N 282.752 3.165 70 20 CGID CN(Cc1cccn1C)C(=O)c1cccc(C(F)(F)F)c1 160350654 XPFQHFZSOPRJIQ-UHFFFAOYSA-N 296.292 3.316 70 20 CGID CCC(CC)n1nccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1 160519734 GIUNXWDYKJCKNE-BETUJISGSA-N 277.412 3.362 70 20 CGID CCCC1(CN[C@@H](C(=O)OC)c2ccc(F)cc2)CC1 160774918 DIDPREYSIZXVJX-CQSZACIVSA-N 279.355 3.210 70 20 CGID CCc1nc([C@H](C)N[C@@H](C)C(=O)OC(C)(C)C)cs1 160904787 UYTMUVYQTZEFSN-UWVGGRQHSA-N 284.425 3.086 70 20 CGID CCC[C@H](C(=O)NCc1cccc(OC)c1)C(C)C 160930669 PXPBFTKRXHZRMY-HNNXBMFYSA-N 263.381 3.384 70 20 CGID CCCCn1ncc(NC(=O)N(C)[C@@H](C)CC)c1C 159730731 XMZYAPLZRKPIAJ-NSHDSACASA-N 266.389 3.254 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)c(F)c1 159361519 DCPAQQJAWJNUNG-ZDUSSCGKSA-N 291.366 3.356 70 20 CGID C=CCC(CC=C)C(=O)Nc1cccc(S(=O)(=O)F)c1 460095400 URBYKWAVCQFXIZ-UHFFFAOYSA-N 297.351 3.052 70 20 CGID CC[C@@H](S[C@@H]1CCN(C)C1=O)c1ccc(F)cc1 161354440 WBFGJGNPSAWPAS-CHWSQXEVSA-N 267.369 3.241 70 20 CGID COCCC(=O)NCCc1ccc(-c2ccccc2)cc1 160057537 JPSFUEKZLSAROR-UHFFFAOYSA-N 283.371 3.049 70 20 CGID O=C(CCc1cccc(F)c1F)NCC1(C2CC2)CC1 160105652 FUPNGBQBJCAUJI-UHFFFAOYSA-N 279.330 3.204 70 20 CGID CCOc1ccc(CN[C@H]2CCOC(C)(C)C2)cc1OC 160470568 XPTIUVVVOZXVEU-AWEZNQCLSA-N 293.407 3.141 70 20 CGID CC(C)(C)SCCCC(=O)NCc1ccc(O)c(F)c1 160733090 WVCOJGZASDIGJY-UHFFFAOYSA-N 299.411 3.459 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(C(=O)OC)c(F)cc1F 160845742 BTFGUUUVOVWSMT-VFZGTOFNSA-N 297.301 3.126 70 20 CGID Cc1cccc(C)c1NC(=O)N[C@H]1CCOC(C)(C)C1 160951097 YAEBBTUKOCMDHQ-ZDUSSCGKSA-N 276.380 3.383 70 20 CGID CCS[C@H]1CCC[C@@H](N[C@@H](C)[C@@H]2CCOC2)C1 159389779 PLOSILGSXVRRFR-DGAVXFQQSA-N 257.443 3.065 70 20 CGID COc1ccc2cc([C@H](C)S(=O)(=O)Cl)ccc2c1 384088333 SBSMZVFYCKIWJI-VIFPVBQESA-N 284.764 3.478 70 20 CGID CCc1noc(C)c1C[S@](=O)c1cc(F)ccc1F 161056333 HIUDEEXJODHDIA-LJQANCHMSA-N 285.315 3.131 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)Cc1c[nH]c2cc(F)ccc12 161421423 JYPPJMUDACRUFX-QWRGUYRKSA-N 274.339 3.249 70 20 CGID CCCC1(CNC(=O)NCc2cccs2)CC1 160232877 HOTGXEGJRGLEDK-UHFFFAOYSA-N 252.383 3.128 70 20 CGID CCCNC(=O)c1cccc(CN[C@H](CC)C(C)C)c1 160616942 JLCOHJPJEAWPFY-MRXNPFEDSA-N 276.424 3.351 70 20 CGID O=C(N[C@@H]1CCCc2occc21)N1CCC2(CCC2)C1 160670849 QGONWYZTZYKUOL-CYBMUJFWSA-N 274.364 3.243 70 20 CGID CC(C)N(C)C(=O)c1cncc(-c2ccccc2)c1 160822654 JSOHMZCAHCANJW-UHFFFAOYSA-N 254.333 3.229 70 20 CGID CCS[C@@H]1CC[C@H](N(C)Cc2cnc3ccccn23)C1 160879405 WHRSHVDZHDFYOC-DZGCQCFKSA-N 289.448 3.440 70 20 CGID CC[C@H](NCCc1cc(C)cc(C)c1)[C@@H]1CCOC1 159498724 HXAFESIJJNBSKZ-SJORKVTESA-N 261.409 3.251 70 20 CGID Cc1cc(C)cc(-c2cc(NC(=O)[C@H]3CC[C@H](C)O3)[nH]n2)c1 159696579 SOHUMAZBMLTTCB-SWLSCSKDSA-N 299.374 3.200 70 20 CGID CCN(Cc1ccoc1)Cc1c(C)nc2ccccn12 159561342 PWBSEFOJWXDDPV-UHFFFAOYSA-N 269.348 3.258 70 20 CGID Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccccc2)n1 159795801 HQIFMNDUXWXJKH-QGZVFWFLSA-N 295.386 3.166 70 20 CGID CC(C)(C)c1nc(CN2CC[C@@H]3CCCC[C@@H]32)no1 159736142 QRDWVFBPSFRXFI-RYUDHWBXSA-N 263.385 3.132 70 20 CGID O[C@@H](CNCc1coc2ccccc12)c1ccccc1 159801908 VRYKJVVOVVRIAG-INIZCTEOSA-N 267.328 3.256 70 20 CGID Cc1ccc(OCC(=O)N2[C@@H](C)CC[C@@H]2C)cc1C 161405685 GTRHCWZDNPLQCL-KBPBESRZSA-N 261.365 3.082 70 20 CGID C[C@@H](OC1CCCCCC1)C(=O)NCC1(C2CC2)CC1 160091121 RPGIMKUVYLNJST-CYBMUJFWSA-N 279.424 3.421 70 20 CGID CC[C@H](NC(=O)c1[nH]c(C)cc1C)c1c(C)noc1C 160211853 PWWXHXIPIFTXLJ-LBPRGKRZSA-N 275.352 3.117 70 20 CGID CCN1CC[C@@H](NCCOc2cccc(Cl)c2)[C@H](C)C1 160252663 KCXKDCUPXHLDGW-CZUORRHYSA-N 296.842 3.039 70 20 CGID C[C@H](CC(=O)NCCCC(C)(C)CO)c1ccccc1F 160370838 IBXZKUXCZORWRT-CYBMUJFWSA-N 295.398 3.234 70 20 CGID COCc1ccc(CN(C)Cc2ccccc2OC)cc1 160417352 SQIAYBSJGPHPES-UHFFFAOYSA-N 285.387 3.474 70 20 CGID Cc1nc2ccccn2c1CN(CC1CC1)CC1CC1 160461433 FKDONUOBOAZVTR-UHFFFAOYSA-N 269.392 3.265 70 20 CGID CCc1cc(O)nc(CN[C@H](c2ccccc2)C(C)C)n1 160586434 WCPJKCXBTFCFLI-KRWDZBQOSA-N 285.391 3.232 70 20 CGID COc1cc(C(=O)NC[C@H]2CC=CCC2)ccc1Cl 160701024 HXRVUQOXMUBAIW-NSHDSACASA-N 279.767 3.435 70 20 CGID CCCC1(CNC(=O)C[C@H](C)c2ccncc2)CC1 160721991 PAMHSGWLNHCFEM-ZDUSSCGKSA-N 260.381 3.272 70 20 CGID O=C(CC1CCCC1)N1CCc2c(F)cccc2C1 160962597 AJUCSKIXJCSFCA-UHFFFAOYSA-N 261.340 3.291 70 20 CGID COc1ccc(CN(C)Cc2cccc3c2OCO3)cc1 159855031 FBIBECOKPVDGHM-UHFFFAOYSA-N 285.343 3.056 70 20 CGID C[C@H](c1cccc(F)c1)N1CCN(Cc2cccnc2)CC1 159484116 JVIFMZAOJBYVMD-OAHLLOKOSA-N 299.393 3.100 70 20 CGID CCC(C)(CC)C(=O)NC[C@H](C)c1c(C)noc1C 159361944 WDCVGPYTWBKFPM-JTQLQIEISA-N 266.385 3.337 70 20 CGID CC[C@@H](C)[C@H](O)CNC(=O)CCC(C)(C)c1ccccc1 159399428 PQWMXIFMFQZGQP-GDBMZVCRSA-N 291.435 3.268 70 20 CGID Cc1cccc([C@H]2CCCN2CCOC(C)(C)C)n1 159842214 IZPDSJBKULLAGD-OAHLLOKOSA-N 262.397 3.342 70 20 CGID CCN(CC)C(=O)NCCc1cccc(Br)c1 217489423 LTDJVEPJPQKXKV-UHFFFAOYSA-N 299.212 3.043 70 20 CGID CCCC1CCC(NC(=O)c2ccc(O)cc2O)CC1 218210619 XQUPIKPUSZKIJZ-UHFFFAOYSA-N 277.364 3.187 70 20 CGID COc1cc(F)c(C(=O)Nc2ccccc2F)cc1OC 161169490 KGPZJOVELQXNRF-UHFFFAOYSA-N 293.269 3.234 70 20 CGID CCOc1ccc(NC(=O)N[C@]2(C)CCOC2)cc1Cl 161315884 QHPSALJCOYRNKF-CQSZACIVSA-N 298.770 3.039 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)CCSC 160021601 DSAOYHOHFSTIJK-UHFFFAOYSA-N 260.447 3.207 70 20 CGID CCCOCC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 160136267 QXFHBVZZVFHYAQ-SFHVURJKSA-N 298.386 3.022 70 20 CGID CCN(C(=O)C[C@H](C)c1ccncc1)c1cccnc1 160385757 QWODPWRDRVATCT-ZDUSSCGKSA-N 269.348 3.023 70 20 CGID O=C(Oc1ccccc1)c1csc([C@@H]2CCCO2)n1 160491472 FJJKHTNADPQHFL-LBPRGKRZSA-N 275.329 3.214 70 20 CGID CC(C)[C@@H](Cc1ccccc1)C(=O)NC1CC=CC1 160772964 AAQFBYAQCITJJV-MRXNPFEDSA-N 257.377 3.336 70 20 CGID CC[C@H](NCC1(C)COC1)c1ccc(F)cc1F 160915190 SCYHUHBFXFFNNT-ZDUSSCGKSA-N 255.308 3.042 70 20 CGID Cc1conc1NC(=O)[C@@H](OC(C)(C)C)c1ccccc1 160950352 PDRBHKFUCMKRQG-ZDUSSCGKSA-N 288.347 3.478 70 20 CGID CC(C)c1ccc(NC(=O)N[C@H]2CC[C@H](O)CC2)cc1 159862376 GLOXEOPJHXUAJZ-GASCZTMLSA-N 276.380 3.235 70 20 CGID CCCCc1nnc(NC(=O)N[C@H](C)C2CCC2)s1 159506747 YJHNDFFEXACKJR-SECBINFHSA-N 282.413 3.191 70 20 CGID CC(C)c1nc(COc2c(F)cccc2F)no1 159376979 BRLSXTHTSOWNGA-UHFFFAOYSA-N 254.236 3.050 70 20 CGID Cc1cccc(C(=O)N[C@@H](C)CCc2ccco2)c1F 161410875 RJBLQZYELYHPMU-LBPRGKRZSA-N 275.323 3.478 70 20 CGID C[C@@H]1CC/C(=C\C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 776368138 OHMOCSZYZDGJIM-OYVNLZQHSA-N 297.351 3.030 70 20 CGID C[C@H](NC(=O)N[C@@H]1CCOC(C)(C)C1)c1ccccc1 161100442 NBALLTBLJOSYPC-GXTWGEPZSA-N 276.380 3.004 70 20 CGID CN1CCC[C@@H]2CN(C(=O)C3CCC(C)(C)CC3)CC[C@@H]21 161306358 VOWLTPNTNPWGNG-CVEARBPZSA-N 292.467 3.146 70 20 CGID Cc1nc(C)c(C(=O)NCC(C)(C)C2CCCC2)o1 160095913 UXOCGTNLRITPPH-UHFFFAOYSA-N 264.369 3.238 70 20 CGID CCC[C@H](C(=O)N1CC(=O)N(C)c2ccccc21)C(C)C 160121284 OEABEFTYILVAOG-ZDUSSCGKSA-N 288.391 3.068 70 20 CGID CC1(C)CCCC[C@@H]1CC(=O)NC[C@@H]1CCN(C2CC2)C1 160133016 XLFABQJVMFXJTB-LSDHHAIUSA-N 292.467 3.193 70 20 CGID Cc1ccc2c(c1)[C@@H](NC(=O)N[C@@H](C)CC(C)C)CO2 160531510 GNUHIRPPISAUNM-JSGCOSHPSA-N 276.380 3.162 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1ccn(-c2ccccc2)n1 160838677 MVASWRCLUPLMIV-XJKSGUPXSA-N 269.348 3.247 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)c2ccccc2)n1 160965251 DPBLNEYPOTXBKV-UHFFFAOYSA-N 292.342 3.286 70 20 CGID CNC(=O)c1cccc(CCN[C@H](C)c2ccccc2C)c1 159667695 ISPDUZXFFMQRQD-OAHLLOKOSA-N 296.414 3.248 70 20 CGID C[C@@H]1CCC[C@H](C(=O)NCc2cccc(CN(C)C)c2)C1 159716838 FICARLJCDKSFRB-PBHICJAKSA-N 288.435 3.191 70 20 CGID CC(C)CCn1ccc(NC(=O)N(C)CC2CCC2)n1 159736430 AIOXYKHSQVNZQK-UHFFFAOYSA-N 278.400 3.193 70 20 CGID CCC(CC)(CC)CNC(=O)NC1C[C@H](C)O[C@@H](C)C1 159966849 BOVPNYRVEQCQPL-STQMWFEESA-N 284.444 3.458 70 20 CGID CC(C)C[C@@H](CCO)CNc1nc(C(C)(C)C)ns1 159779899 XLLWXGQKGDZLHX-LLVKDONJSA-N 285.457 3.292 70 20 CGID CC(C)Sc1ccccc1NC(=O)C[C@H]1CCCN1 160348193 CLAWSKFKJFOXPE-GFCCVEGCSA-N 278.421 3.268 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1F 161038386 NFXMAOUGOGQYBE-UBHSHLNASA-N 282.378 3.488 70 20 CGID Cc1cc(OCc2ccccc2)ccc1NC(=O)C(C)(C)N 160844207 QGCAKCKDOJAZOM-UHFFFAOYSA-N 298.386 3.250 70 20 CGID COc1ccc(N(C)C(=O)[C@H](C)C2CC2)cc1Cl 159901125 BVLSXTAGJFQGQX-SECBINFHSA-N 267.756 3.358 70 20 CGID Cc1nc(CCNCc2cccc3cc[nH]c23)cs1 218098126 WPSJWIVGLMHQHM-UHFFFAOYSA-N 271.389 3.265 70 20 CGID C[C@@H](NC(=O)NO[C@@H]1CCCCO1)c1ccccc1Cl 161234106 AJNQMOQMBNRSIZ-ZWNOBZJWSA-N 298.770 3.158 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1ccnc2ccccc12 161418018 SRZUWLAAOMEDMH-TXEJJXNPSA-N 254.333 3.248 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc2cccc(F)c2o1 160025000 MGNLPCDJPMBLMR-UHFFFAOYSA-N 273.307 3.492 70 20 CGID CCc1c(C(=O)Nc2ccc(C)nc2)cnn1CC(C)C 160490144 XJVZKVQTRUUTQX-UHFFFAOYSA-N 286.379 3.057 70 20 CGID CC(C)C[C@H](CO)NC(=O)CCc1ccc(C(C)C)cc1 160694909 TYKRTZFBKMDPRN-QGZVFWFLSA-N 291.435 3.266 70 20 CGID Cc1ccc(CNC(=O)c2cc(F)cc3cccnc23)cn1 160808259 GQDCPEJUSOWIPN-UHFFFAOYSA-N 295.317 3.007 70 20 CGID CCS[C@H]1CC[C@H](N(C)Cc2cnc3ccccn23)C1 160879553 WHRSHVDZHDFYOC-ZFWWWQNUSA-N 289.448 3.440 70 20 CGID Cc1cc(NC(=O)c2ccc(CC(C)C)cc2)c[nH]c1=O 159604840 MUDBQMDKNXNNHQ-UHFFFAOYSA-N 284.359 3.134 70 20 CGID CCC(C)(CC)C(=O)Nc1nc(-c2nccn2C)cs1 159491029 RLXSFOIDAVDKDQ-UHFFFAOYSA-N 292.408 3.308 70 20 CGID CC(C)CONC(=O)Nc1ccc(COC(C)C)cc1 159556400 FAZDMFDYQPLBDK-UHFFFAOYSA-N 280.368 3.321 70 20 CGID COCCC(C)(C)C(=O)N[C@@H]1CCCc2sccc21 159984183 OUQIDISMYSDVLH-GFCCVEGCSA-N 281.421 3.304 70 20 CGID O=C(C1=CCCC1)N(Cc1cccs1)C[C@@H]1CCCO1 159795246 KEYUYAMVACEFAU-AWEZNQCLSA-N 291.416 3.366 70 20 CGID Nc1c(Cl)cc(C(=O)NC(C2CC2)C2CC2)cc1Cl 159673135 XVMLOKCMWAUFJV-UHFFFAOYSA-N 299.201 3.494 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2nc(C)c(C)o2)n1 160148888 CKGVIDSMJYHAIT-OAHLLOKOSA-N 271.364 3.332 70 20 CGID CCc1ncnc(NCCc2cccc(C)c2)c1F 218000034 KUOZVHGOENESLY-UHFFFAOYSA-N 259.328 3.141 70 20 CGID Cc1ccsc1[C@H]1C[C@H]1c1nc(-c2cnccn2)no1 161030145 UZYSVTOTZYZFEH-VHSXEESVSA-N 284.344 3.168 70 20 CGID CC[C@@H](NCC1(c2ccc(F)cc2)CC1)c1cnn(C)c1 161350048 YYHPPZRUWWVEFB-MRXNPFEDSA-N 287.382 3.332 70 20 CGID Cn1nccc1CSc1cc2c(cc1Cl)OCCO2 161367269 XZMAFSSTNICIQW-UHFFFAOYSA-N 296.779 3.137 70 20 CGID CCCCN(CC)C(=O)COc1ccc2[nH]ccc2c1 160021519 JZKLFOHQLVWFKP-UHFFFAOYSA-N 274.364 3.195 70 20 CGID CCC1CCC(CNC(=O)N(C)C[C@H]2CCC[C@@H]2O)CC1 160109992 RWKUIASZOVXCQN-FJBKBRRZSA-N 296.455 3.005 70 20 CGID CC(C)(C)n1nnnc1SCC(=O)CCC1CCCC1 160161698 GCFQJTMQVNAXMM-UHFFFAOYSA-N 296.440 3.060 70 20 CGID Cc1cccc2c1CCN2C(=O)C[C@@H](C)c1ccncc1 160271867 LFIQDALOAJYDHD-CQSZACIVSA-N 280.371 3.473 70 20 CGID Brc1ccc(N[C@@H]2CCO[C@H](C3CC3)C2)nc1 160468721 YPGQFJURZVQSCN-NEPJUHHUSA-N 297.196 3.214 70 20 CGID Cc1cc(C)c(C(=O)N[C@H]2CCOC3(CCCCC3)C2)[nH]1 160954028 DDSITJTYFMIGBC-AWEZNQCLSA-N 290.407 3.243 70 20 CGID Cn1ccc(NC(=O)CCc2cc(Cl)cc(Cl)c2)n1 159452821 SKIBYTXNLQHDKI-UHFFFAOYSA-N 298.173 3.298 70 20 CGID CCC(C)(CC)C(=O)NCC[C@H](C)N1CCCCC1 159477335 YKMOCRMFBRAFJA-AWEZNQCLSA-N 268.445 3.193 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2nnsc2Cl)n1 160215433 QJDZMWQYVKTKAW-GFCCVEGCSA-N 294.811 3.232 70 20 CGID O=C(NC1CC=CC1)c1c(F)cccc1Br 160766743 BZGHBPLSWFGLNS-UHFFFAOYSA-N 284.128 3.037 70 20 CGID COC(=O)[C@@H](NCc1cccc2cc[nH]c12)c1ccccc1 161038067 IDVTXDFZDGTNIK-KRWDZBQOSA-N 294.354 3.172 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CCn1cc(C)cn1 161267305 RQDMZTAFFNHIDY-CABCVRRESA-N 277.412 3.009 70 20 CGID CCCCNC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 160185177 OGBWAGXSMUUDJY-WCQYABFASA-N 282.409 3.020 70 20 CGID CC(=O)Nc1cccc([C@@H](C)NC[C@H]2CCC(C)(C)O2)c1 160223809 LTSNVTMEUBMCEH-MLGOLLRUSA-N 290.407 3.253 70 20 CGID CC(C)c1ccc(-c2ncc(CS(C)(=O)=O)s2)cc1 160403185 NIJROXHJPNANAX-UHFFFAOYSA-N 295.429 3.478 70 20 CGID Cc1cc(C)nc(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160577282 IWJIGZXMEHQNQP-HOTGVXAUSA-N 283.375 3.426 70 20 CGID c1ccc(C[C@H]2CCN(Cc3cnc4ccccn34)C2)cc1 160594407 AAWGCCBWKQVZHT-QGZVFWFLSA-N 291.398 3.399 70 20 CGID Cc1cc(NC(=O)C[C@@H](C)c2c(C)n[nH]c2C)ccc1O 160673558 MGGBVSMXBZIQIQ-SNVBAGLBSA-N 287.363 3.173 70 20 CGID COC(=O)c1csc(NC(=O)N2CCCC(C)(C)C2)c1 160733364 OUERHDROOOTGCA-UHFFFAOYSA-N 296.392 3.189 70 20 CGID CCC[C@@H](CC)NC(=O)Nc1ccn(CC(F)(F)F)n1 160790566 XXDBUTHODRISBZ-SECBINFHSA-N 292.305 3.146 70 20 CGID COc1ccc([C@@H](NCc2cn(C)nc2C)C(C)C)cc1 159638844 RENJWQCOJWCJRR-KRWDZBQOSA-N 287.407 3.224 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)OCCC(C)C 159723425 NLWFIZVGWZMARQ-MGPQQGTHSA-N 255.402 3.133 70 20 CGID CC(C)NCCC(=O)N(C)[C@H](c1ccccc1)C(C)C 159756004 XDIYILAAFJYYFP-KRWDZBQOSA-N 276.424 3.230 70 20 CGID CCOc1ccc(N[C@@H](C)CCn2cccn2)cc1OC 159379533 HNBYIWGKYBROKG-ZDUSSCGKSA-N 289.379 3.181 70 20 CGID CC[C@H]1C[C@@H](Nc2ccc(F)c(OC)c2)CCO1 159967522 YQSYSJVLYUOSFY-RYUDHWBXSA-N 253.317 3.204 70 20 CGID CC(C)C(=O)NCCCN[C@@H]1CCCCc2ccccc21 159973165 ZHIHUYJYMNVLOC-QGZVFWFLSA-N 288.435 3.206 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccccc1F 160999317 KGSYORZOLLUYOG-RDBSUJKOSA-N 264.388 3.349 70 20 CGID C[C@H](C(=O)N[C@H]1CCOC2(CCCCC2)C1)C1CC1 161021609 ODMNHTZWNOPZLP-JSGCOSHPSA-N 265.397 3.031 70 20 CGID C[C@H](CCO)CNC(=O)C1CCC(c2ccccc2)CC1 161048622 STPKJPIFTUMGKQ-ODIFPOPNSA-N 289.419 3.095 70 20 CGID CCCC[C@H](CC)CC(=O)N(C)C1C[C@@H]2CC[C@H](C1)N2 161502596 WKRBIOYJFNVERJ-LSVZVQIISA-N 280.456 3.334 70 20 CGID CC1CCC(NC(=O)COc2ccc3[nH]ccc3c2)CC1 160053543 HHFNFGRYUAKRTA-UHFFFAOYSA-N 286.375 3.242 70 20 CGID C[C@H](N[C@@H]1CCCN(c2ccccc2F)C1=O)C1CCC1 160215667 IFLKJHUDSNBEMC-SWLSCSKDSA-N 290.382 3.099 70 20 CGID CC[C@H](OC1CCCCC1)C(=O)Nc1cccc(F)n1 160556325 WUWCOXYWELLBBR-LBPRGKRZSA-N 280.343 3.287 70 20 CGID CC[C@H](NCCCCc1nc(C)cs1)c1cnn(C)c1 160643387 FTADXGYYKBWIHS-AWEZNQCLSA-N 292.452 3.249 70 20 CGID CC1(CC(=O)Nc2ccc3c(c2)CC(=O)N3)CCCCC1 160648427 SYICCDCQJMWPQO-UHFFFAOYSA-N 286.375 3.480 70 20 CGID CO[C@H](C(=O)NCCCSCC(C)C)c1ccccc1 160696754 ZAYAFVHEJKEDFR-HNNXBMFYSA-N 295.448 3.270 70 20 CGID C[C@@H](NCc1nnc(-c2ccccc2)s1)c1ccncc1 160743129 NODIAQGFDKEZRJ-GFCCVEGCSA-N 296.399 3.451 70 20 CGID CCCC1CCC(NC(=O)CO[C@H](C)CC)CC1 160765407 WMKYXOYULNZNSY-IYXRBSQSSA-N 255.402 3.277 70 20 CGID CCc1ccc([C@H](CO)Nc2cc(C)nc(C3CC3)n2)cc1 160915010 SRXKXVYZPLVARZ-INIZCTEOSA-N 297.402 3.370 70 20 CGID Cc1nc2c(s1)[C@H](N[C@H]1CCCSC1)CCC2 159619846 PYIPMHCGDRCGQQ-CMPLNLGQSA-N 268.451 3.314 70 20 CGID CC(C)[C@H](C)CC(=O)N[C@H]1CCOC2(CCCC2)C1 159874304 KJZVTIMLGCHQLJ-KGLIPLIRSA-N 267.413 3.277 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cc(-c2cccs2)n[nH]1 159689447 WDJRLNVLZQZVBE-UHFFFAOYSA-N 287.388 3.058 70 20 CGID CCc1cnc(NC(=O)c2cc(C(C)C)on2)s1 159492583 BUJKUXWHLGVWFY-UHFFFAOYSA-N 265.338 3.069 70 20 CGID Cc1cccc(NC(=O)c2cnc(C(F)(F)F)nc2)c1F 159920698 VXTYAGHDQCGNNC-UHFFFAOYSA-N 299.227 3.195 70 20 CGID CC1(C(=O)N[C@H]2CCCc3cc(N)ccc32)CCCC1 159376525 TUCOITKTFVIWDT-HNNXBMFYSA-N 272.392 3.343 70 20 CGID CC(C)(C)OC(=O)Nc1ccc(NCc2ncc[nH]2)cc1 159407262 YRLVYNUFEILLMZ-UHFFFAOYSA-N 288.351 3.369 70 20 CGID C1CCN(CCCN2CCC3(CCCC3)C2)CC1 161317989 OSEXMYIKGUBJLM-UHFFFAOYSA-N 250.430 3.129 70 20 CGID CC[C@H]1CCCCN1C(=O)NCc1ccc(F)cc1 217270197 ZCVFKPUZAOBJPV-AWEZNQCLSA-N 264.344 3.300 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCCc1nc2ccccc2s1 160146343 LVJCTSCIXARCHD-BDJLRTHQSA-N 288.416 3.391 70 20 CGID CCOc1cncc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160548116 BWPXWXYUXBCMOV-HUUCEWRRSA-N 299.374 3.208 70 20 CGID C[C@H](NC(=O)Nc1ccc2c(c1)CCC2)C1CCC1 159511315 MEZMTWJLPQZHLU-NSHDSACASA-N 258.365 3.485 70 20 CGID C[S@@](=O)c1cccc(NC(=O)CCC(C)(C)C)c1 159732573 DJICNHUBNLVVSQ-SFHVURJKSA-N 267.394 3.189 70 20 CGID CC1(C)C[C@H](NCc2cc(F)c(F)c(F)c2)CCO1 160632457 RPVUZJHVYUFHAS-SNVBAGLBSA-N 273.298 3.151 70 20 CGID CCC(CC)(CN)C(=O)N[C@@H](C)CCC(C)(C)C 161237986 IVGOITVVEZOXJD-LBPRGKRZSA-N 256.434 3.083 70 20 CGID C[C@@H](c1ccco1)N(C)CCCN1CCCCC1 161299408 WQHFHYROCGHYGM-AWEZNQCLSA-N 250.386 3.148 70 20 CGID O=S(=O)(Cl)[C@H](c1ccccc1)c1ccc(F)cc1 88251664 RBHPDLUIEMMQRT-CYBMUJFWSA-N 284.739 3.484 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cc(F)ccc1F 161020130 HASNSYCWBQBDHU-XBFCOCLRSA-N 282.378 3.488 70 20 CGID Cc1nc(NC(=O)c2cc(C(C)C)on2)cc(C2CC2)n1 161283331 VVALLLANNJOGIW-UHFFFAOYSA-N 286.335 3.026 70 20 CGID C[C@H](NCCC1CCN(CC(F)(F)F)CC1)C1(C)CC1 160026385 YDDHBXVSNNGOOJ-LBPRGKRZSA-N 292.389 3.429 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)N(C)Cc1cnn(-c2ccccc2)c1 160219299 HIQJYHJVYDXSFQ-WMZOPIPTSA-N 297.402 3.267 70 20 CGID CC(C)c1nsc(N[C@@H]2CCO[C@H](C3CC3)C2)n1 160373294 SZAWLLVJPHMHGE-MNOVXSKESA-N 267.398 3.031 70 20 CGID CNC(=O)c1cccc(NCc2cc(F)cc(F)c2)c1C 160434884 WMJZTSLEMWSOHD-UHFFFAOYSA-N 290.313 3.245 70 20 CGID Cc1cc(NC(=O)N(C)CC2CCOCC2)ccc1F 160575279 JDBSRKXEAOHYFH-UHFFFAOYSA-N 280.343 3.024 70 20 CGID CC1(C)C[C@H](Nc2ccc(C(F)(F)F)cn2)CCO1 160625851 FFUJCUNYXGROQT-SNVBAGLBSA-N 274.286 3.470 70 20 CGID O=C(Nc1cccc(OC(F)(F)F)c1)[C@@H]1CCCCO1 160701900 ITNHGUMNSRPBDY-NSHDSACASA-N 289.253 3.093 70 20 CGID Cc1ccccc1C1(CNC(=O)c2ccnn2C(C)C)CC1 160838430 BEGMFXSBAZCISC-UHFFFAOYSA-N 297.402 3.234 70 20 CGID CC[C@H]1CCC[C@H]1NC(=O)CCCc1ccccn1 159802718 VQLTTWWIQYRDPM-DZGCQCFKSA-N 260.381 3.099 70 20 CGID Cc1cccc(C(=O)N[C@@H]2CCCc3sccc32)n1 159994188 LEEGJKMGFVRILN-GFCCVEGCSA-N 272.373 3.259 70 20 CGID CCCC1(CNC(=O)c2cc3ccccc3[nH]2)CC1 160661111 MKDIQOTZDSGFJO-UHFFFAOYSA-N 256.349 3.478 70 20 CGID CC(C)[C@@H](Sc1ccncc1)C(=O)NC(C)(C)C 159900385 PKJPKUZLCUNUGD-GFCCVEGCSA-N 266.410 3.113 70 20 CGID FC(F)(F)c1ccc(N[C@@H]2CCN3CCCC[C@@H]23)nc1 217359946 BIVVMANDXILWOB-NEPJUHHUSA-N 285.313 3.139 70 20 CGID COCCC1(CNC(=O)N(CC(C)C)CC(C)C)CC1 161112412 HDYQIAJAXHYPNF-UHFFFAOYSA-N 284.444 3.127 70 20 CGID CC(C)n1nccc1C(=O)N1CCC[C@H]1c1ccccc1 161178821 FAOQJGZOPDHTRH-HNNXBMFYSA-N 283.375 3.441 70 20 CGID Clc1ncc(CSCc2nc(C3CC3)no2)s1 161497339 OVQVROGYVZUASV-UHFFFAOYSA-N 287.797 3.490 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1OC 160141757 HEROGYQGGWJHBI-FABXCBLPSA-N 291.391 3.317 70 20 CGID CC(C)[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccccc1 160232543 NYWDBUGYPAKWAG-LSDHHAIUSA-N 261.365 3.069 70 20 CGID Cc1ccc(-c2nnc(NC(=O)CC3=CCCCC3)[nH]2)o1 160408035 LFFQJKACAATNNK-UHFFFAOYSA-N 286.335 3.202 70 20 CGID Cc1cc(C(=O)NCCC[C@@H]2CCCCO2)cc(Cl)n1 160542605 HKTQXZNJKBEJDE-ZDUSSCGKSA-N 296.798 3.123 70 20 CGID CC(C)Oc1ccccc1Cn1cnc(C(C)C)cc1=O 160671690 LDHQINSMVQSCGW-UHFFFAOYSA-N 286.375 3.202 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cc(C)on1 160876371 WRSGILJEIPXSDU-AAEUAGOBSA-N 250.342 3.024 70 20 CGID Cc1cc(NC(=O)[C@H](C)Cc2ccccc2F)ccn1 159925687 IGQDTQRDUSTENK-LLVKDONJSA-N 272.323 3.346 70 20 CGID CSCCNC(=O)c1cncc(-c2ccc(C)cc2)c1 159748824 ZAYMSHCYYDPSIN-UHFFFAOYSA-N 286.400 3.150 70 20 CGID CCOCCC1(CN[C@@H](C)c2cccnc2)CCC1 159978572 CNPBJVAHVSXJGP-AWEZNQCLSA-N 262.397 3.329 70 20 CGID CCONC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 159594918 RXVDCZSLBIOQNS-SECBINFHSA-N 275.270 3.267 70 20 CGID CCCCCn1cc(CNC(=O)OC(C)(C)C)cn1 159710399 ANYAWTWUUPJVQW-UHFFFAOYSA-N 267.373 3.098 70 20 CGID CSC[C@@H]1CCCN1CCC(=O)c1ccc(C)cc1 160305296 FVFNKPBYDYYJQN-HNNXBMFYSA-N 277.433 3.395 70 20 CGID CC(C)(C)C1=CCN(C(=O)c2ccccc2O)CC1 160990286 LZTZDCVLFQAZDC-UHFFFAOYSA-N 259.349 3.211 70 20 CGID COCCCCNc1ncc(Cl)cc1Br 159577929 RIIGDOYMRMDYDB-UHFFFAOYSA-N 293.592 3.336 70 20 CGID FC(F)(F)Oc1cccc(CNCCc2ccncc2)c1 217862001 HRNLANZQQSBDFL-UHFFFAOYSA-N 296.292 3.313 70 20 CGID Cc1nc2ccccc2cc1C(=O)NCCCOC(C)C 217475466 FZJVBBMLIOUULU-UHFFFAOYSA-N 286.375 3.088 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2ccncc2)n1 159943810 RFIWZJUFGGWZTI-INIZCTEOSA-N 253.349 3.122 70 20 CGID CN(C)c1ccc(NC(=O)NCc2cccc(F)c2)cc1 217311523 YGWHWTTXHYFJNR-UHFFFAOYSA-N 287.338 3.213 70 20 CGID CC1(C(=O)NCCc2csc(C(C)(C)C)n2)CCC1 160756503 HQCJZAWYRHHERN-UHFFFAOYSA-N 280.437 3.290 70 20 CGID COC[C@@H](NC(=O)[C@@H](C)Cc1ccc(Cl)cc1)C1CC1 161284080 XWEJRCWVSGOWKM-XHDPSFHLSA-N 295.810 3.060 70 20 CGID CC(C)[C@H](CCc1ccccc1)NC1CCN(C)CC1 161506719 DTNXRCCOENHOBF-SFHVURJKSA-N 274.452 3.328 70 20 CGID Cc1cc(Oc2ccc(NC(=O)[C@H]3C[C@H]3C3CC3)cc2)n[nH]1 160474662 OCOPQYPGCLTVIJ-GJZGRUSLSA-N 297.358 3.495 70 20 CGID O=C(c1ccccc1)N1CC=C(C(F)(F)F)CC1 160582441 UHAZQYJEDFGHKW-UHFFFAOYSA-N 255.239 3.021 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)Cc1ccc(C)nc1 160905841 FGAZBRIGQDIKNN-JKSUJKDBSA-N 274.408 3.360 70 20 CGID CC[C@@H](C(=O)N(C)CCOCC1CC1)c1ccc(F)cc1 160965907 JJQKBUHEKMEJGC-MRXNPFEDSA-N 293.382 3.204 70 20 CGID Cc1ccc(S(=O)(=O)CC(=O)C2CCCCC2)cc1C 159481675 CRKNHEVQMJSBKO-UHFFFAOYSA-N 294.416 3.227 70 20 CGID c1ccc2sc([C@H]3CCCN3Cc3cc[nH]n3)nc2c1 160721765 QPHSBBRWXGHKAX-CYBMUJFWSA-N 284.388 3.357 70 20 CGID CCO[C@H]1C[C@@H](NCc2cccc(F)c2F)C1(C)C 217901587 GODVSDLYNRIAQT-OLZOCXBDSA-N 269.335 3.258 70 20 CGID O=C(Nc1cccnc1)N[C@H]1CCCc2sccc21 161166530 WECUKAHWAWXXPH-LBPRGKRZSA-N 273.361 3.342 70 20 CGID CC(C)Cc1noc(-c2cc(F)c(F)cc2F)n1 161286881 PIYMVAXOKSVCMH-UHFFFAOYSA-N 256.227 3.352 70 20 CGID CC[C@H](CN[C@@H]1CCN(C)[C@H](C)C1)Oc1ccccc1F 160304870 DBPAPNUZBTXZBM-RBSFLKMASA-N 294.414 3.055 70 20 CGID Cc1nc(CC(=O)N(C)c2ccccc2F)c(C)s1 160478662 QTMNJWCERYXMPR-UHFFFAOYSA-N 278.352 3.105 70 20 CGID CS[C@@H](C)CC(=O)Nc1cnn(Cc2ccccc2)c1 160522132 IRAHUNPDSISVIK-LBPRGKRZSA-N 289.404 3.012 70 20 CGID CC(C)Oc1cncc(C(=O)NC2(C)CCCCC2)c1 160543955 ZYDVOIWXRHQZEX-UHFFFAOYSA-N 276.380 3.321 70 20 CGID CCc1ccc(CCNC(=O)C[C@@H](C)c2ccncc2)cc1 160700835 GVYNONZZTSLICO-OAHLLOKOSA-N 296.414 3.497 70 20 CGID CCCN(C)C[C@@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160817289 DIMDMRUWEPYQRJ-HNNXBMFYSA-N 294.483 3.393 70 20 CGID CCc1ccc([C@@H](C)CC(=O)N[C@H](CO)CC(C)C)cc1 160989839 QJNLYMGBMPYKHA-YOEHRIQHSA-N 291.435 3.266 70 20 CGID CCOCCCC(=O)N[C@H]1CCCc2sccc21 159867787 LSRIHOVXGCWVIB-LBPRGKRZSA-N 267.394 3.058 70 20 CGID CC(C)CC(C)(C)CNC(=O)NC1C[C@H](C)O[C@@H](C)C1 159695303 HERVFNNYEYTHGC-STQMWFEESA-N 284.444 3.314 70 20 CGID Cc1ccccc1CN[C@H]1[C@H]2CCO[C@@H]2C12CCC2 159561624 XAIJZGSBURXJEG-PMPSAXMXSA-N 257.377 3.042 70 20 CGID CC[C@@H](O)[C@@H]1CCCCN1CCC(=O)c1ccc(C)cc1 159763445 BDEHNURFLMUXKD-DLBZAZTESA-N 289.419 3.193 70 20 CGID C[C@H](NC(=O)Nc1ccc(F)c(F)c1)C1CCC1 159386066 HONSACHHQZJXFZ-QMMMGPOBSA-N 254.280 3.275 70 20 CGID CSC[C@H]1CCCN1C(=O)c1ccc(F)cc1C 159417598 FEZBVBUMIZQZGX-GFCCVEGCSA-N 267.369 3.102 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCC[C@@H](OC)C2)cc1 160108224 CQBUVDIMPBWJCJ-JGGQBBKZSA-N 263.381 3.303 70 20 CGID CC1CCN(C(=O)N2CCC[C@@H]3CCCC[C@@H]32)CC1 160373589 UMCMLVCOJAZTOX-GJZGRUSLSA-N 264.413 3.493 70 20 CGID CC1(C)CC[C@@H](COC(=O)c2ccc(Cl)c(N)c2)O1 160779094 VVGYSEGPHYRGLD-JTQLQIEISA-N 283.755 3.037 70 20 CGID CCNCC1CCN(C(=O)C[C@@H]2CCC[C@@H](C)C2)CC1 161088718 UDJCHVAVHMXIDB-GDBMZVCRSA-N 280.456 3.051 70 20 CGID CCCCOc1ncccc1CNC(=O)C[C@H](C)SC 161167476 PTACETKDNPEFRR-LBPRGKRZSA-N 296.436 3.018 70 20 CGID CCCCCNC(=O)Nc1cnn(CCCC)c1C 160199598 QJAHETGZJONLEQ-UHFFFAOYSA-N 266.389 3.303 70 20 CGID CCCc1ccc([C@H](C)N[C@H](CCO)CSC)cc1 160252292 KZJXDDJRNJNGKW-XJKSGUPXSA-N 281.465 3.404 70 20 CGID CCN1CCC(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 160336882 WUKAHNKROUSABG-BZUAXINKSA-N 292.467 3.193 70 20 CGID CC(C)n1cccc1C(=O)Nc1ccc2c(c1)OCO2 160412958 SQYRROWVQAYLOI-UHFFFAOYSA-N 272.304 3.050 70 20 CGID CCOCCC1(C(=O)N(C)Cc2ccccc2F)CCC1 160583581 KMFNGJKXPFNRDW-UHFFFAOYSA-N 293.382 3.381 70 20 CGID CCC(CC)n1nccc1C(=O)NCc1ccc(F)cc1 160650286 OCWTYYMWMZGKII-UHFFFAOYSA-N 289.354 3.313 70 20 CGID Cc1csc(CCCCN[C@@H](C)C2CCN(C)CC2)n1 160718967 FOAVSFOTJHINAK-AWEZNQCLSA-N 295.496 3.094 70 20 CGID Cc1ccccc1NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 160929054 PHRVJTDQIUQRGP-UKRRQHHQSA-N 274.364 3.074 70 20 CGID CCOCCC1(C(=O)N[C@H]2CCCC[C@H]2C)CCC1 160954337 LTKBWGSCWNYRQT-KGLIPLIRSA-N 267.413 3.278 70 20 CGID C[C@@H](CC(=O)N1CCOCC1(C)C)c1ccc(F)cc1F 160958941 URDZCCBIJZXOKA-NSHDSACASA-N 297.345 3.096 70 20 CGID CC(C)CCSCC(=O)N[C@@H]1CCOC2(CCCC2)C1 159611729 PWVJMQGQYPLDSB-CQSZACIVSA-N 299.480 3.374 70 20 CGID COCCCC(=O)N1C[C@@H](C)CSc2ccccc21 159619556 DMFNCFAEHIKYCW-GFCCVEGCSA-N 279.405 3.188 70 20 CGID C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)N(C)CC1CCOCC1 159644835 SDUBWJZUIAICLK-HIFRSBDPSA-N 296.455 3.269 70 20 CGID C/C=C(\C=C\C(=O)Nc1ccc2c(c1)NC(=O)CC2)CC 159845633 ZHTVZUFSVNTJAZ-HHYQCNRSSA-N 284.359 3.422 70 20 CGID NC1C[C@@H]2CCC[C@H](C1)N2Cc1cccc2cccnc12 159569879 OTUJCVGQDMEBAL-ALOPSCKCSA-N 281.403 3.079 70 20 CGID Cc1cnc(COC(=O)[C@@H]2C[C@@H]2c2sccc2C)cn1 159394154 UDFQOELEVLSJCM-QWHCGFSZSA-N 288.372 3.002 70 20 CGID CC[C@H](N[C@H](C)c1ccc(OC(C)C)cc1)C(=O)OC 159489472 JIEDODWTHFIJPB-DOMZBBRYSA-N 279.380 3.076 70 20 CGID CCc1cccc(OCCSc2nc(C)cc(N)n2)c1 216660403 GSJJRVOUZCJSDQ-UHFFFAOYSA-N 289.404 3.101 70 20 CGID Clc1cc(N[C@H]2CCO[C@@H](C3CC3)C2)ccn1 160300127 SEUJDUXDPQZMOB-NWDGAFQWSA-N 252.745 3.105 70 20 CGID CCN(CCNCc1cccc(C2CC2)c1)C1CC1 217414196 HZCIEMYKVMVTDZ-UHFFFAOYSA-N 258.409 3.138 70 20 CGID CCc1ncnc(NCCCOc2ccccc2)c1F 217962621 IHFNFFPJDHSMRE-UHFFFAOYSA-N 275.327 3.059 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CC[C@@H]1CCCO1 161121436 QGGXFGAWOBJMAD-ILXRZTDVSA-N 267.413 3.373 70 20 CGID Cc1cc(C(=O)N[C@H](C)c2cccc3ccccc23)ncn1 161252062 AGNSUTURUSHLGL-CYBMUJFWSA-N 291.354 3.429 70 20 CGID COC[C@@H](NC(=O)CCC(C)(C)c1ccccc1)C1CC1 161254555 WOODAAGQGLMVHU-MRXNPFEDSA-N 289.419 3.286 70 20 CGID Cc1ccc(NC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)cn1 161369179 RRQGKBPLPKJAMI-CABCVRRESA-N 285.322 3.207 70 20 CGID CCCC1(CNC(=O)NCCc2cccs2)CC1 160233142 IYOBCBSZLAYNPP-UHFFFAOYSA-N 266.410 3.170 70 20 CGID Cc1nc(CC(=O)NCc2ccc(F)c(C)c2)c(C)s1 160661813 FHOHGULPKZIBFD-UHFFFAOYSA-N 292.379 3.066 70 20 CGID CN(Cc1cccn1C)C(=O)C1(Cc2ccccc2)CCC1 160834111 DTLNJFLKDXDOKI-UHFFFAOYSA-N 296.414 3.397 70 20 CGID Cc1ccc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)o1 160863242 MSNJKVDIPQFCAW-ZDUSSCGKSA-N 277.364 3.200 70 20 CGID CCC[C@H]1[C@H](C)CCCN1C(=O)NCCc1cscn1 159478700 YSPVAXDOIKSKFE-OCCSQVGLSA-N 295.452 3.296 70 20 CGID C[C@H](NC(=O)[C@H]1CC[C@@H](C)O1)[C@@H](C)C1CCCCC1 159679248 MWCZBOSLDOYNIV-GUIRCDHDSA-N 267.413 3.275 70 20 CGID CC(C)(C)c1nsc(N2CCO[C@@H](c3ccco3)C2)n1 159911141 RNXQCXDFZPJMJA-LLVKDONJSA-N 293.392 3.007 70 20 CGID COc1cc(CCC(=O)N[C@H](C)C(C)C)ccc1Cl 159721840 JJVOCSVSMGDZRK-LLVKDONJSA-N 283.799 3.442 70 20 CGID Cc1cc(C)c(NC(=O)N[C@H]2CC[C@H](O)CC2)c(C)c1 159765197 JQXAZRKVVYNBIP-OKILXGFUSA-N 276.380 3.037 70 20 CGID C[C@H]1Cc2ccccc2[C@H]1NC[C@](C)(O)c1ccsc1 159964730 KVCBYWHSTXVBCQ-ZLIFDBKOSA-N 287.428 3.479 70 20 CGID CC1(C)C[C@H](NC[C@@H]2CCOc3ccccc32)CCO1 159776387 BCXIPPBHZDONRE-UONOGXRCSA-N 275.392 3.100 70 20 CGID C[C@@H](NCC1(CO)CCCC1)c1ccc2c(c1)CCC2 160091212 WJLKIOHIXKZXJL-CQSZACIVSA-N 273.420 3.379 70 20 CGID CCCn1nccc1CN[C@@H](C)c1cc(C)oc1C 160126123 JCWMKLIKNYVYQC-LBPRGKRZSA-N 261.369 3.354 70 20 CGID CCCn1nccc1CNc1cccnc1OC(C)C 160116270 AMTQBUMMYHFWHI-UHFFFAOYSA-N 274.368 3.087 70 20 CGID CCC(=CC(=O)Nc1cccc(S(=O)(=O)F)c1)CC 809281416 NAZDFIIXRAPDCR-UHFFFAOYSA-N 285.340 3.030 70 20 CGID CO[C@@H](CNc1nc(C(C)(C)C)ns1)C(C)(C)C 159780455 HDXKWQHJESIONX-VIFPVBQESA-N 271.430 3.309 70 20 CGID O=S(=O)(Cl)c1ccc(-c2ccccc2)c(F)c1 112734356 BDAQHLRPAUPBNA-UHFFFAOYSA-N 270.712 3.420 70 20 CGID C[C@H]1CN(C(=O)c2ccc(CN)o2)CC[C@H]1c1ccccc1 161235040 BRVHSNXLLHAUJA-XJKSGUPXSA-N 298.386 3.004 70 20 CGID O=C(/C=C/c1ccccc1)N[C@@H]1CCOC2(CCCC2)C1 161433986 ZINPDQPCVOUNKA-ROJDOSBLSA-N 285.387 3.308 70 20 CGID CCOc1ccccc1CNC(=O)Nc1ccc(C)nc1 161496066 NKZPKCPCDIQITL-UHFFFAOYSA-N 285.347 3.110 70 20 CGID NCc1ccccc1NC(=O)C1C2CC3CC(C2)CC1C3 160202818 RSZQCUQWQLWSHF-UHFFFAOYSA-N 284.403 3.156 70 20 CGID C[C@@H](C[C@@H]1CCCO1)NC(=O)C1CCC(C)(C)CC1 159803094 LVBNUZQVNIIYPU-JSGCOSHPSA-N 267.413 3.277 70 20 CGID CCC[C@@H]1CN(C(=O)[C@H](c2ccccc2)C2CC2)CCO1 159461181 QPLLGIDKODOQRE-IAGOWNOFSA-N 287.403 3.208 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(Br)cn1 159878118 FSCLVZLNEIKKDG-SKDRFNHKSA-N 283.169 3.219 70 20 CGID CCOC(C)(C)CNC(=O)c1ccc2ccccc2c1O 159488556 ZGOYXGODHDQFKK-UHFFFAOYSA-N 287.359 3.090 70 20 CGID CCN(CCn1ccnc1)Cc1cccc(Cl)c1 159749667 JCSDLHQDZNKTPA-UHFFFAOYSA-N 263.772 3.059 70 20 CGID Cc1ccccc1C(=O)N[C@H]1CCCc2cc(N)ccc21 159364943 PVGBOMOZTODECM-KRWDZBQOSA-N 280.371 3.385 70 20 CGID CCCN(CCCOCC)[C@@H](C)C(=O)Nc1ccccc1 159954607 AOTODQCXEQGFTI-HNNXBMFYSA-N 292.423 3.152 70 20 CGID CC1(C(=O)N[C@@H]2CCCc3cc(N)ccc32)CCCC1 159376391 TUCOITKTFVIWDT-OAHLLOKOSA-N 272.392 3.343 70 20 CGID CC(C)CC[C@@H](C)NC(=O)NCCc1ccccc1F 218052092 IPKBSBZWQWQUPY-CYBMUJFWSA-N 280.387 3.492 70 20 CGID FC(F)Oc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1 217643460 XOZASSFMMFUZNR-GJZGRUSLSA-N 296.361 3.004 70 20 CGID CC(C)c1ccc(S(=O)(=O)N(C)C2CCCC2)cc1 217057146 OWGFFEUDPNYPBS-UHFFFAOYSA-N 281.421 3.373 70 20 CGID CCCn1nc(C)c(-c2ccc(S(=O)(=O)F)cc2)c1C 854196223 SDSLEMDZDYADGY-UHFFFAOYSA-N 296.367 3.235 70 20 CGID CCc1ccc(NC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)cc1 161016630 XJNNLSWYJVKYIY-HZPDHXFCSA-N 288.391 3.328 70 20 CGID O=C(NCCCC1CCCCC1)NOCc1cccnc1 161085757 JAADKGPSDLHWOK-UHFFFAOYSA-N 291.395 3.173 70 20 CGID CC[C@@H]1CCCC[C@@H]1NCc1cnn(C)c1C(F)(F)F 161432965 KONUQQJQHLLILA-PWSUYJOCSA-N 289.345 3.497 70 20 CGID CCC[C@@H](N)C(=O)NC1(c2ccccc2)CCCCC1 160049859 PDRYKESGCFRLGP-OAHLLOKOSA-N 274.408 3.090 70 20 CGID C[C@@H]1CCCN1[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 160097591 FDUFBCXOERTYKD-QMTHXVAHSA-N 296.773 3.069 70 20 CGID O=C(C[C@H]1CSCCS1)N1CCC[C@H]1C1CCCC1 160251836 YHOQRAYEWUOFQF-KBPBESRZSA-N 299.505 3.406 70 20 CGID CC(C)[C@@H]1CCCC[C@@H]1Nc1ccc(OCC(N)=O)cc1 160306617 FYJSPEOLCRUCDN-HOTGVXAUSA-N 290.407 3.177 70 20 CGID CC(C)c1nsc(N[C@H]2CCO[C@@H](C3CC3)C2)n1 160373653 SZAWLLVJPHMHGE-WDEREUQCSA-N 267.398 3.031 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 160518197 JZMWDUPDEIWPHT-RHSMWYFYSA-N 286.375 3.410 70 20 CGID Cn1nccc1CN(Cc1ccco1)Cc1cccs1 160660413 FKLMDNRGMXNNHP-UHFFFAOYSA-N 287.388 3.277 70 20 CGID CC[C@@H](C(=O)NC[C@@H](OC)C(C)(C)C)c1ccc(F)cc1 160642271 LHEZDINOHIIHMF-HUUCEWRRSA-N 295.398 3.497 70 20 CGID CCC[C@@H](N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 160987911 ADHGPSZDZTWJFU-LDYMZIIASA-N 289.206 3.298 70 20 CGID CCc1nnc([C@@H](C)N[C@@H](C)c2cccc(F)c2F)o1 159406331 AXRQIKOLQJMERN-DTWKUNHWSA-N 281.306 3.322 70 20 CGID Cc1ccc(CN(C)C)cc1N[C@@H](C)CCn1cccn1 159473714 YBAFIAUSNCRPNX-HNNXBMFYSA-N 286.423 3.144 70 20 CGID c1ccn2c(CN3CCC[C@@H]3C3CCC3)cnc2c1 159698130 JTYAXRSUIJBGQD-OAHLLOKOSA-N 255.365 3.099 70 20 CGID CC1(C)CC(NCc2cccc(C(N)=O)c2)CC(C)(C)C1 159722732 QQBUDESHHQUXRX-UHFFFAOYSA-N 288.435 3.480 70 20 CGID CCc1nnc(NC(=O)Nc2cscc2C)s1 159773155 LFPSURBRBGSFAV-UHFFFAOYSA-N 268.367 3.114 70 20 CGID Cc1nccn1CCCCN1CC[C@@H](c2ccccc2)C1 159783480 IXOPFFQXFLJLRZ-GOSISDBHSA-N 283.419 3.461 70 20 CGID Cc1ccc(CCNC(=O)Nc2cc(Cl)ccn2)cc1 217307954 SKZZFQTXWYRWAN-UHFFFAOYSA-N 289.766 3.408 70 20 CGID CCCCCNC(=O)[C@@H](C)SCc1c(CC)noc1C 160005918 PQDILYGXDGUURZ-GFCCVEGCSA-N 298.452 3.474 70 20 CGID O=S(=O)(Cl)CCCCOc1ccccc1Cl 100495528 PCRMJYSINOWKPX-UHFFFAOYSA-N 283.176 3.068 70 20 CGID CCCn1nccc1CNc1ccc(OCC)c(OC)c1 160044213 WXLQHLGBMKJJJC-UHFFFAOYSA-N 289.379 3.313 70 20 CGID C[C@@H](C1CC1)N(C)C(=O)c1cc(F)cc2cccnc12 160247242 XRPLFFCKFGZDND-JTQLQIEISA-N 272.323 3.244 70 20 CGID COc1ccc(NC(=O)[C@@H](C)c2c(F)cccc2F)cn1 160375915 ZMFUAUFUAASRPW-VIFPVBQESA-N 292.285 3.111 70 20 CGID FC(F)(F)c1cccc(OCCN[C@H]2CCSC2)c1 160492676 DOKRADRJXCFDFE-NSHDSACASA-N 291.338 3.179 70 20 CGID CCC(C)(C)C(=O)Nc1cccc(OCCF)c1 160593990 GYOPTKLIHRETRS-UHFFFAOYSA-N 253.317 3.410 70 20 CGID C[C@H]1CCC[C@H](C(=O)NCCCCN2CCC[C@H](C)C2)C1 160634789 JVNILEALBWWLID-ULQDDVLXSA-N 294.483 3.441 70 20 CGID Cc1ccc(C(C)(C)C(=O)N(C)Cc2cccn2C)cc1 160717263 MMPXWDMEOVVPAV-UHFFFAOYSA-N 284.403 3.270 70 20 CGID CC[C@@H](NCCN(C)CCOC)c1ccc(Cl)s1 159411575 RIQFPYYNNURYSM-LLVKDONJSA-N 290.860 3.020 70 20 CGID Cc1ccc(N2CC[C@H](Sc3ccncc3)C2=O)cc1 159874170 NAVFNJRWMNFQCP-HNNXBMFYSA-N 284.384 3.288 70 20 CGID C[C@H](CC(=O)NCC1(N)CCCCC1)c1ccccc1F 159765644 WIBBLDUSXQMRSU-CYBMUJFWSA-N 292.398 3.097 70 20 CGID CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(Cl)cc1 159986301 LVAFHEKHTLUPFL-QJPTWQEYSA-N 282.815 3.294 70 20 CGID CC(C)N(C(=O)COc1ccc2[nH]ccc2c1)C(C)C 160037130 NGZPKVANMHSXKQ-UHFFFAOYSA-N 274.364 3.192 70 20 CGID Cc1cccc(F)c1NC(=O)CCc1cncc(F)c1 160058138 AVCAJWYPWXRSID-UHFFFAOYSA-N 276.286 3.240 70 20 CGID COc1cc(CNC(=O)C[C@H](C)c2ccncc2)ccc1C 160204269 MJLVUOVYSMJOSQ-AWEZNQCLSA-N 298.386 3.209 70 20 CGID Cc1cccc2ncnc(NCCCC(=O)OC(C)C)c12 160254016 KAHJRTVHVAKYIW-UHFFFAOYSA-N 287.363 3.082 70 20 CGID CCOCCC1(CNC(=O)NCC2(C3CC3)CC2)CCC1 160631859 NSOWIAVVLKKOND-UHFFFAOYSA-N 294.439 3.073 70 20 CGID Cc1ccccc1NC(=O)N[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 160657527 KVOMNYLNNFXBBN-QEJZJMRPSA-N 286.375 3.074 70 20 CGID CC[C@H](C)[C@@H](C)N[C@@H](CN1CCCC1=O)c1ccccc1 160660724 IFEFSYCIZQCZMC-UXLLHSPISA-N 288.435 3.374 70 20 CGID Cc1c(CNC(=O)C2(N)CCCCC2)oc2ccccc12 160818535 RWNRCNHWURCBIZ-UHFFFAOYSA-N 286.375 3.019 70 20 CGID CCOCCNC(=O)c1ccccc1OC1CCCCC1 160912096 VIBPJBBEPZRZCZ-UHFFFAOYSA-N 291.391 3.164 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cnn(C(C)(C)C)c1C 159643820 VCKIVHOYGBTHJE-JSGCOSHPSA-N 277.412 3.255 70 20 CGID COc1ccc(CNC(=O)N2c3ccccc3C[C@H]2C)cc1 217271360 MJAZBQSCQDKAMT-CYBMUJFWSA-N 296.370 3.356 70 20 CGID CN1CCC[C@H](CN[C@H](c2ccccc2)C2CC2)C1 217564313 LCVZKWSLHUBYLA-RHSMWYFYSA-N 258.409 3.069 70 20 CGID CC1(CNCc2ccc(Br)c(F)c2)CC1 217856121 TZMVHRIDDIHDRO-UHFFFAOYSA-N 272.161 3.478 70 20 CGID CC[C@@H](NC(=O)[C@@H]1CC=CCC1)c1c(C)noc1C 160104394 LULORQCPYARZHJ-CHWSQXEVSA-N 262.353 3.215 70 20 CGID CC[C@H](C)OCC(=O)N1CCC[C@@H]1c1cccc(C)c1 160212163 DBCYDINVIXNZOK-GOEBONIOSA-N 275.392 3.474 70 20 CGID CCC[C@H](C(=O)NCCc1ccccc1OC)C(C)C 160237136 TUGSGCYFTFSKKL-HNNXBMFYSA-N 277.408 3.426 70 20 CGID C[C@@H](CC(=O)N1CCCC(C)(C)C1)c1ccncc1 160341693 GGECCEWLOZSSHG-ZDUSSCGKSA-N 260.381 3.224 70 20 CGID O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@H]1C[C@@H]1C1CC1 160457622 FPJQHUIVMARMDK-ZNMIVQPWSA-N 277.408 3.031 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1cccc(F)n1 160541937 CLHNUIDSAIWRLD-UWVGGRQHSA-N 276.336 3.333 70 20 CGID CC(C)C[C@@H]1CCN(C(=O)c2ccc(N(C)C)cc2F)C1 159436832 KKVJWCGMVSPXRC-ZDUSSCGKSA-N 292.398 3.400 70 20 CGID COc1cc(CCC(=O)NCCC(C)C)ccc1Cl 159379586 YARCNWYSYZTPLD-UHFFFAOYSA-N 283.799 3.444 70 20 CGID CCN(Cc1ccc(OC)c(OC)c1)C(=O)C1=CCCC1 159770287 QUAXURVSDCTNEW-UHFFFAOYSA-N 289.375 3.163 70 20 CGID Cn1nncc1CNc1cccc(-c2cccs2)c1 159393012 AUFCHRGARWYVMU-UHFFFAOYSA-N 270.361 3.156 70 20 CGID CCCCOCCCN[C@@H](C)C[C@@H]1CCCCCN1 160259112 LTWAHOUDPWRRMX-HOTGVXAUSA-N 270.461 3.094 70 20 CGID COCCOCCCCNCc1ccc(Cl)cc1F 160891223 DEQYMSDWANOMHU-UHFFFAOYSA-N 289.778 3.012 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1cccc(F)c1 161111561 LWCZMMHXEYBBES-RCBQFDQVSA-N 264.388 3.349 70 20 CGID CC(C)OCCNc1cc(F)ccc1Br 159622838 NPFGQHMEWYGELU-UHFFFAOYSA-N 276.149 3.425 70 20 CGID CCc1ccc(CNC(=N)Nc2ccccc2)s1 217998502 DHGDRZTVYVOWSM-UHFFFAOYSA-N 259.378 3.447 70 20 CGID COc1ccccc1[C@H](C)NCCc1ccc2c(c1)OCO2 161124742 GLFJOPIQMNIIFV-ZDUSSCGKSA-N 299.370 3.317 70 20 CGID COc1cc(F)c(C(=O)Nc2ccccc2)cc1OC 161131767 SJSJEMATAKMKTN-UHFFFAOYSA-N 275.279 3.095 70 20 CGID OCc1cc2ccccc2nc1N[C@@H]1CCO[C@H](C2CC2)C1 160442117 WGAKYQGYJIOCOY-WBVHZDCISA-N 298.386 3.097 70 20 CGID CN(Cc1ccc(N2CCCC2)nc1)Cc1cccc(F)c1 160462400 RXOAHRAGDLEQAT-UHFFFAOYSA-N 299.393 3.453 70 20 CGID CN(Cc1ccc(OC(F)F)cc1)Cc1ccc(CO)o1 160625511 FLIRIZHGGTVFOE-UHFFFAOYSA-N 297.301 3.005 70 20 CGID Cc1nnc(CSCc2ccc(Cl)cc2)n1C 160947413 XCAWPEMYNVGUOK-UHFFFAOYSA-N 267.785 3.210 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H]2CCCc3c2cnn3C)C1 159451786 NXOHMMIVWODTET-GZBFAFLISA-N 293.480 3.451 70 20 CGID CC[C@H](C(=O)N(C)CC(F)F)c1ccc(F)cc1 159784296 MLYVGQFTDAKPQO-NSHDSACASA-N 259.271 3.043 70 20 CGID CCOc1ncc(C(=O)NCC2(C3CC3)CC2)cc1Cl 159796255 SFEGEQUAJUNCSU-UHFFFAOYSA-N 294.782 3.054 70 20 CGID Cc1cccc(N[C@H]2CCCc3cc(N)ccc32)n1 159493895 MTCLGCCMWBPCEX-HNNXBMFYSA-N 253.349 3.462 70 20 CGID CC(C)(C)[C@H]1CCN(C(=O)c2ccc3c(c2)NCC3)C1 159553197 JGAOZPCILSGSPG-AWEZNQCLSA-N 272.392 3.163 70 20 CGID CCC[C@@H](CCO)CNC(=O)c1cccc(Cl)c1F 159836008 QJVAYZPSOQNCSR-JTQLQIEISA-N 287.762 3.008 70 20 CGID CCN(CC(=O)N1C[C@@H](C)C[C@@H](C)C1)c1ccc(F)cc1 216707340 SEZDWMGFHHDCAA-OKILXGFUSA-N 292.398 3.157 70 20 CGID C[C@@H]1CCCCN1CCC(=O)Nc1ccc2c(c1)CCC2 217665708 LMPHKVODNGAGTR-CQSZACIVSA-N 286.419 3.378 70 20 CGID CN(CCn1ccnc1)Cc1cc(Cl)cc(Cl)c1 159759848 JUVPKLDSWMRINA-UHFFFAOYSA-N 284.190 3.322 70 20 CGID CN(C(=O)c1c(F)cccc1Br)C1CCC1 161005732 HNGJZUZENKIJNO-UHFFFAOYSA-N 286.144 3.213 70 20 CGID COc1ccccc1[C@@H](C)NCCc1ccc2c(c1)OCO2 161124862 GLFJOPIQMNIIFV-CYBMUJFWSA-N 299.370 3.317 70 20 CGID CCOC(=O)C1CCC(NC(=O)[C@H]2CCC[C@H](C)C2)CC1 161347345 FSYBVMJXEALUJO-LQULJDIASA-N 295.423 3.051 70 20 CGID C[C@H](N[C@H]1CCN(C2CCCCC2)C1=O)c1ccccc1 160157014 OSGKUNZRCXNAGJ-YOEHRIQHSA-N 286.419 3.271 70 20 CGID FC(F)(F)c1nnc(NC[C@@H]2CCCCS2)s1 160189072 DVWXWIRCHPHTGP-LURJTMIESA-N 283.344 3.255 70 20 CGID Cc1cccc2nc(CN[C@H]3CC(C)(C)OC3(C)C)cn12 160338341 KHIDLMIOBKCTCZ-AWEZNQCLSA-N 287.407 3.078 70 20 CGID C[C@@H](CC(=O)NC[C@H]1CCc2ccccc21)c1ccncc1 160539394 WBYKKIONYMRGED-WMLDXEAASA-N 294.398 3.421 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1cccc(F)n1 160541825 CLHNUIDSAIWRLD-ZJUUUORDSA-N 276.336 3.333 70 20 CGID C[C@@H](C1CC1)N(CCCN1CCCCC1)C1CC1 160578303 CAADLFTYEXUTND-AWEZNQCLSA-N 250.430 3.125 70 20 CGID CCOCCCN[C@H](CC)c1ccc(F)cc1F 160656408 OVXQJZFUYFIKJW-CQSZACIVSA-N 257.324 3.432 70 20 CGID CC(C)OC(=O)CSCc1noc(C2CCCCC2)n1 159831255 XARAGSUKEUPLEK-UHFFFAOYSA-N 298.408 3.302 70 20 CGID COc1ccc(N(C)C(=O)CCc2ccsc2)cc1F 159755962 DPPXKKPBDBPKHP-UHFFFAOYSA-N 293.363 3.491 70 20 CGID Cc1ccccc1CN[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 159561395 XAIJZGSBURXJEG-JYJNAYRXSA-N 257.377 3.042 70 20 CGID OCC1(CNCc2ccc(C(F)(F)F)cc2)CCCC1 160116351 YYRSQGFATOGYAT-UHFFFAOYSA-N 287.325 3.348 70 20 CGID COc1ccc(CN2CC[C@@H]3OCCC[C@@H]3C2)cc1Cl 161447493 DWQFSSQNMJAIFQ-HIFRSBDPSA-N 295.810 3.350 70 20 CGID CCCCO[C@H](C)C(=O)N[C@H]1CCCc2sccc21 160186253 QRIPUDIZSFGOPS-YPMHNXCESA-N 281.421 3.447 70 20 CGID CC[C@H](NC(=O)C1(CCOC)CCC1)c1c(C)noc1C 160269791 RXALEINIHWSWAX-ZDUSSCGKSA-N 294.395 3.066 70 20 CGID CC[C@@H](C)c1cc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)on1 160312567 CYRHQZALESESOP-BXUZGUMPSA-N 287.363 3.494 70 20 CGID CC(C)(C)c1cnc([S@](=O)C[C@H]2CCCCO2)s1 160453386 KETRRTGLQCXMAF-MGNBDDOMSA-N 287.450 3.117 70 20 CGID CC[C@]1(C)C[C@@H]1C(=O)NCc1ccccc1OC(F)F 160554651 NQCIGIHWBWDDMF-IAQYHMDHSA-N 283.318 3.340 70 20 CGID C/C=C(\C=C\C(=O)NCc1sc(C)nc1C)CC 160567301 SRNULWCOOQQFHD-ZECXQIHBSA-N 264.394 3.289 70 20 CGID CC1(C)C[C@H]1C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 159831794 RCETUFBDAIGDRH-UONOGXRCSA-N 293.794 3.286 70 20 CGID CN(CCn1nc(C2CC2)nc1C1CC1)c1ccccc1 159371490 PTIRVUNSXXYQPM-UHFFFAOYSA-N 282.391 3.169 70 20 CGID CCC[C@H](COC(C)(C)CC)CS(=O)(=O)Cl 114476606 LFHRFIROMTXJRS-SNVBAGLBSA-N 270.822 3.177 70 20 CGID CS[C@@H](C)CC(=O)NCc1cccc(OCC(C)C)c1 161024933 IETACTIZAZPJOM-ZDUSSCGKSA-N 295.448 3.479 70 20 CGID Cc1c(C(=O)NC[C@H](C)CCO)oc2c(Cl)cccc12 161038463 PRMKVJGXTCHANW-SECBINFHSA-N 295.766 3.143 70 20 CGID C[C@@H]1CC[C@@H](C)N1C(=O)CCCc1cccs1 161423683 AGHJWMCIRMJKDS-VXGBXAGGSA-N 251.395 3.470 70 20 CGID O=C(NCC1(C2CC2)CC1)c1cccc(OC(F)F)c1 160045084 GWTAOTZNZXSDMQ-UHFFFAOYSA-N 281.302 3.208 70 20 CGID CC1=C(C(=O)Nc2n[nH]c3c(Cl)cccc23)CCCO1 160758781 ASCAXYVTWWGNGC-UHFFFAOYSA-N 291.738 3.239 70 20 CGID CCOc1cc(F)ccc1NC(=O)NC[C@H](C)SC 160962561 CDDHRXUEGGJLMN-VIFPVBQESA-N 286.372 3.097 70 20 CGID CCOC(=O)c1sc(NC(=O)[C@H]2C[C@@]2(C)CC)nc1C 159437273 BSWSOSOYWCIHJB-YMTOWFKASA-N 296.392 3.003 70 20 CGID CCc1noc(C)c1CNc1ccc(C(=O)OC)c(C)c1 159443274 RWNLXHTXMMJBAH-UHFFFAOYSA-N 288.347 3.253 70 20 CGID Cc1nc2ccccn2c1CN1CCC[C@H]1C1CCC1 159698548 UDVKHQVYNXVJGZ-HNNXBMFYSA-N 269.392 3.407 70 20 CGID C[C@@H](NC(=O)c1ccn(C2CCCC2)n1)c1cccc(O)c1 159703263 IZSSIWIIHGYQRB-GFCCVEGCSA-N 299.374 3.195 70 20 CGID CN(C)[C@H](CNCc1cc(F)cc(F)c1)c1cccs1 159593128 KPNUYFINRUUDRK-CQSZACIVSA-N 296.386 3.419 70 20 CGID CCCn1nccc1CNC12CC3CC(CC(C3)C1)C2 159953384 GVRXVSCBKNAVIG-UHFFFAOYSA-N 273.424 3.352 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)c(F)c1 161131727 DBSLORBFQDQLEA-UBHSHLNASA-N 282.378 3.488 70 20 CGID CCOc1ccc([C@H](C)N[C@@H]2CCN3CCCC[C@@H]23)cc1 217657814 MGUYTXXAPVGMMA-QGTPRVQTSA-N 288.435 3.363 70 20 CGID Cc1cc(Cl)c(S(=O)(=O)Cl)c2cccnc12 59221912 FFFZFRFRFOFSCH-UHFFFAOYSA-N 276.144 3.124 70 20 CGID CCOC(CSc1ccc(C)cc1OC)OCC 217663810 SPVHAGRWFNXBCU-UHFFFAOYSA-N 270.394 3.495 70 20 CGID O=C(Nc1nnc(C2CC2)s1)N1CC[C@@H]2CCCC[C@@H]21 160042878 HNGFRFYKVPPLPH-ONGXEEELSA-N 292.408 3.212 70 20 CGID COCC(=O)Nc1ccc(OC(=O)CCC(C)(C)C)cc1 160241906 VLRPQUXMEOHBIT-UHFFFAOYSA-N 293.363 3.003 70 20 CGID Cc1cc(C)nc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 160577413 IWJIGZXMEHQNQP-HZPDHXFCSA-N 283.375 3.426 70 20 CGID CCCO[C@H]1CCCN(C(=O)NCC(CC)CC)CC1 160587975 LNLDOMDBXDLYFN-HNNXBMFYSA-N 284.444 3.413 70 20 CGID CC(C)[C@H](O)CC(=O)Nc1ccc(OC(C)(C)C)cc1 160830234 QWBHXLXFPGXMOX-CQSZACIVSA-N 279.380 3.209 70 20 CGID COCCCOc1ccccc1NC(=O)C[C@@H](C)SC 160855007 LQKQNOCLPHGTFW-GFCCVEGCSA-N 297.420 3.182 70 20 CGID CCO[C@H](CCNC(=O)C[C@@H](C)c1ccncc1)C(C)C 160971319 IFSGPFJQXLPAPQ-GDBMZVCRSA-N 292.423 3.143 70 20 CGID C[C@H](CCn1cccn1)Nc1cccc(-c2cnco2)c1 159415216 DCSWPPIUOUAXMZ-CYBMUJFWSA-N 282.347 3.429 70 20 CGID CS[C@H](C)CC(=O)Nc1ccc(C)c(NC(C)=O)c1 159818585 FAXUQAUBSUEPQO-SNVBAGLBSA-N 280.393 3.034 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)c2cccnc2)C1 159665933 XFYXYZHDNKHKPA-LBPRGKRZSA-N 284.384 3.470 70 20 CGID NC1(CNC(=O)CCc2cccc(Cl)c2)CCCCC1 159489498 LEDUFWWDMDREKA-UHFFFAOYSA-N 294.826 3.050 70 20 CGID CC(C)[C@H](O)CNC(=O)C1CCC(c2ccccc2)CC1 159748533 VHYGRWDLRNOCLX-OFLPRAFFSA-N 289.419 3.094 70 20 CGID C[C@H](CNC[C@H](O)c1ccccc1F)c1ccccc1 159740504 PFESBCYOULJRJY-DYVFJYSZSA-N 273.351 3.252 70 20 CGID NC1(CNC(=O)c2cc3c(s2)CCCC3)CCCCC1 159744512 NSFHOKHFAANCIB-UHFFFAOYSA-N 292.448 3.018 70 20 CGID Cc1nnc(-c2ccccc2C(=O)N2CCCCCCC2)o1 161221350 SXUFOVGPNAHYCD-UHFFFAOYSA-N 299.374 3.451 70 20 CGID CCO[C@@H]1C[C@H](N[C@@H](C)C2CCOCC2)C1(CC)CC 161320068 FEPRIGWIABDATH-CWRNSKLLSA-N 283.456 3.375 70 20 CGID Fc1cccc(Cn2nc(C3CC3)nc2C2CC2)c1 161467980 XRNUWMOSLAKUEY-UHFFFAOYSA-N 257.312 3.220 70 20 CGID CC(C)c1noc2ncc(C(=O)NCC3(C4CC4)CC3)cc12 160062926 IOCIXJPCYMXENV-UHFFFAOYSA-N 299.374 3.266 70 20 CGID NCc1cccc(NC(=O)C2C3CC4CC(C3)CC2C4)c1 160083743 XGGJZLZWKZFRDT-UHFFFAOYSA-N 284.403 3.156 70 20 CGID CC[C@H](C(=O)NCCCSC)c1ccc(F)cc1 160183474 AWBDKFRAXDYNKK-ZDUSSCGKSA-N 269.385 3.189 70 20 CGID C[C@@H]1C[C@H](NCC2(Sc3ccccc3)CC2)CCN1C 160475748 OMWSFKPFOYIPRP-HUUCEWRRSA-N 290.476 3.384 70 20 CGID CCC(=O)c1cccc(NC(=O)C2[C@H]3CCC[C@H]23)c1 160734794 VMOGYYDRLQKCOJ-STQMWFEESA-N 257.333 3.264 70 20 CGID Cc1cccc2[nH]cc(CC(=O)N(C)Cc3cccn3C)c12 160809621 PVDRDYAAKPKPFM-UHFFFAOYSA-N 295.386 3.016 70 20 CGID CSc1ccc(C(=O)NCCNC2CCCCCC2)o1 159656817 GBIYSQGMVINWGM-UHFFFAOYSA-N 296.436 3.044 70 20 CGID CC(C)(C)[C@H]1CCN(C(=O)CC[C@@H](N)c2ccccc2)C1 159501077 ZMBILOBNFGLLGL-JKSUJKDBSA-N 288.435 3.361 70 20 CGID C/C(=C/c1ccc(Cl)cc1)CNCC(=O)NC(C)(C)C 159938723 OTDUOEQNTMGOBO-XFXZXTDPSA-N 294.826 3.248 70 20 CGID C[C@@H](NCCc1ccc(Cl)nc1)c1ccccn1 159377413 UCBLYRJPGTVDDL-LLVKDONJSA-N 261.756 3.023 70 20 CGID CCS[C@@H]1CCC[C@H](N[C@@H](C)[C@@H]2CCOC2)C1 159389342 PLOSILGSXVRRFR-RFQIPJPRSA-N 257.443 3.065 70 20 CGID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccccc1F 160999190 KGSYORZOLLUYOG-IHRRRGAJSA-N 264.388 3.349 70 20 CGID CCN(CCN[C@H](C)c1cncs1)C(=O)OC(C)(C)C 159457939 AIKKRARVGJRXTK-LLVKDONJSA-N 299.440 3.051 70 20 CGID CN1CCC[C@@H](CN[C@H](c2ccccc2)c2ccco2)C1 217569855 ZMMUNDYXXKULLU-MAUKXSAKSA-N 284.403 3.300 70 20 CGID CC[C@@H](C)NC(=O)NCCCOc1c(C)cccc1C 217298090 JMGOFDYDIHHSEF-CQSZACIVSA-N 278.396 3.170 70 20 CGID O[C@@H](CNC1C2CC3CC(C2)CC1C3)c1ccc(F)cc1 218255285 HMHCIPGMRTWYJF-YHBLYGJFSA-N 289.394 3.273 70 20 CGID CC[C@H](N[C@H](C)C(=O)NC(C)(C)C)c1ccc(F)cc1F 161025137 UKMFEVZJVVPEPG-YGRLFVJLSA-N 298.377 3.309 70 20 CGID CC(C)NCCC(=O)N1C[C@@H](C)C[C@H]1c1cccc(F)c1 161047055 VPGNHNTWYRTURJ-BBRMVZONSA-N 292.398 3.123 70 20 CGID COCCOc1cccc(NC(=O)N[C@H](C)CC(C)C)c1 161058770 UZPSYUHEZXLLEW-CYBMUJFWSA-N 294.395 3.268 70 20 CGID CCC1CCC(CNC(=O)N(C)C[C@@H]2CCC[C@H]2O)CC1 160110104 RWKUIASZOVXCQN-SSHXOBKSSA-N 296.455 3.005 70 20 CGID CC[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(-c2ncn[nH]2)c1 160257785 WEDABHOVPYDMLR-DOMZBBRYSA-N 298.390 3.170 70 20 CGID CCC(N)(CC)CNC(=O)C[C@H](c1ccccc1)C(C)C 160419824 JDPFXPKDHOQLDI-INIZCTEOSA-N 290.451 3.450 70 20 CGID Cc1ccc2c(c1)N(C(=O)c1cnn(CC(C)C)c1C)CC2 160484277 XBOQFEOXMYUKGW-UHFFFAOYSA-N 297.402 3.359 70 20 CGID CCSCCN(CC(=O)Nc1ccc(F)cc1)C(C)C 160574903 GLKJVXXTXRQWDY-UHFFFAOYSA-N 298.427 3.228 70 20 CGID CC(=O)Nc1cccc(NC(=O)c2cccn2C(C)C)c1 160981947 OJHJAMVXRGPJMF-UHFFFAOYSA-N 285.347 3.280 70 20 CGID CCCC[C@H](COC)NC1CC(C)(C)NC(C)(C)C1 159621418 PTQYADCDIDAZPE-CYBMUJFWSA-N 270.461 3.090 70 20 CGID COc1ccc(N(C)C(=O)c2ccccc2F)cc1F 159680889 KANUQIKBZXNBAL-UHFFFAOYSA-N 277.270 3.250 70 20 CGID CCc1ccc(OC(=O)C2=C(C)OCCC2)c(OC)c1 159694030 WHMSSZFMDZCVNY-UHFFFAOYSA-N 276.332 3.247 70 20 CGID Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@H]1CCCNC1 159694067 WXYLECHYZVPIEA-RDJZCZTQSA-N 288.435 3.198 70 20 CGID CC1(C)CCC(C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]23)CC1 159362494 QHHPPYNMEMCVIB-RBSFLKMASA-N 279.424 3.277 70 20 CGID Cc1ccc(NC(=O)[C@H]2CCCCO2)c(Cl)c1 159381881 URNAPVBCOIJULS-GFCCVEGCSA-N 253.729 3.156 70 20 CGID CC(C)Sc1ccccc1NC(=O)c1ccc(CN)o1 160347669 KLCUORMLSLINNK-UHFFFAOYSA-N 290.388 3.491 70 20 CGID CCc1ccc(NC(=O)N[C@H]2CCO[C@H](C3CC3)C2)cc1 161016527 XJNNLSWYJVKYIY-HOTGVXAUSA-N 288.391 3.328 70 20 CGID COCc1ccc([C@H]2CCCN2C(=O)CC(F)(F)F)o1 161325540 VJKDTZVIIZLUFV-SNVBAGLBSA-N 291.269 3.042 70 20 CGID CCN(CC1CC1)C(=O)Nc1ccn(CCC(C)C)n1 161328422 ZTZHHUCZLVSKIS-UHFFFAOYSA-N 278.400 3.193 70 20 CGID Cc1ccc2c(c1)OCCC[C@@H]2NC[C@H]1CCCC[C@@H]1O 160497404 CAWGTGOGJAHGMX-PVAVHDDUSA-N 289.419 3.349 70 20 CGID O=C(Nc1ccc(Cc2ccncc2)cc1)[C@H]1CCCCO1 160518524 UDTGYKQFQXQYNM-QGZVFWFLSA-N 296.370 3.180 70 20 CGID CN(Cc1ccc(Br)cc1)Cc1ccn(C)c1 160799005 NLOWKMYZCIZHKI-UHFFFAOYSA-N 293.208 3.420 70 20 CGID CCc1noc(C)c1CNc1ccccc1OCCOC 159416938 IOZIZVZZLKPCJA-UHFFFAOYSA-N 290.363 3.183 70 20 CGID Cc1cc(NC(=O)[C@H](C)c2cc3ccccc3o2)c[nH]c1=O 159482947 MALQITBOFFKZPW-LLVKDONJSA-N 296.326 3.172 70 20 CGID CC(C)CC[C@H](NCCO)c1ccc(Cl)cc1 159698513 BTOKDCCWPKOUMR-AWEZNQCLSA-N 255.789 3.399 70 20 CGID CCOc1ccccc1N(C)Cc1nnc(C(C)C)o1 159368480 UDIQYCMGCBSBTJ-UHFFFAOYSA-N 275.352 3.228 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(OC)cc1F 159616397 UMDYFKFKSLPBBS-YGRLFVJLSA-N 265.328 3.143 70 20 CGID CC(C)N1CCC(NCc2cc(F)cc(Cl)c2)CC1 160824029 KCCUEZRFTVXJLU-UHFFFAOYSA-N 284.806 3.442 70 20 CGID C/C=C(/c1ccccc1)N(CCOCC)C(=O)CCl 140397817 PZIMAGUZSAVMKB-BNNQUZSASA-N 281.783 3.151 70 20 CGID CCc1ncc(NC(=O)N(CC(C)C)CC(C)C)cn1 161190746 JETXLLOZBQVLKL-UHFFFAOYSA-N 278.400 3.185 70 20 CGID CO[C@@H]1CCCC[C@H]1NC(=O)Nc1ccnc(C)c1Cl 160005738 YDYIXHYLUIHKBD-ZYHUDNBSSA-N 297.786 3.123 70 20 CGID C[C@H](NC[C@](C)(O)c1ccsc1)C1CCCC1 160099453 VZTIHESBASRMNR-FZMZJTMJSA-N 253.411 3.124 70 20 CGID CCCCN(C)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 160373151 WGAOHQQSAZCVAG-OAHLLOKOSA-N 292.379 3.118 70 20 CGID CCc1nc(C(=O)N[C@@H]2CCCc3sccc32)co1 160484915 WDLAYYXBNVOAQT-SNVBAGLBSA-N 276.361 3.106 70 20 CGID Cc1ccc2c(c1)OCCC[C@H]2NC[C@H]1CCCC[C@@H]1O 160497534 CAWGTGOGJAHGMX-OIISXLGYSA-N 289.419 3.349 70 20 CGID CCCN(CCN(CC)CC)C(=O)Nc1ncc(C)s1 160543989 SPYFPWLDKQCYCF-UHFFFAOYSA-N 298.456 3.037 70 20 CGID CCCc1ccccc1NC(=O)N[C@H]1CC[C@H](O)CC1 160562333 HNCVUQBCHAWMOC-OKILXGFUSA-N 276.380 3.064 70 20 CGID CC[C@@H](NC(=O)CCc1ccccc1)c1c(C)noc1C 160582375 TZTBBWSYZKEBSZ-OAHLLOKOSA-N 286.375 3.492 70 20 CGID COCCCN(C)C(=O)/C(C)=C/c1cccc(Cl)c1 160761834 FYNFWVOQYMZGDS-ZRDIBKRKSA-N 281.783 3.238 70 20 CGID O=C(N[C@H]1CCCc2sccc21)[C@H]1C[C@@H]1C1CC1 159816249 CQRFHOHQMSLUSE-AGIUHOORSA-N 261.390 3.288 70 20 CGID C[C@@H](CC(=O)N1CCC[C@H]1C1CCC1)c1ccncc1 159950631 RDZKMEBGPYSYOG-BBRMVZONSA-N 272.392 3.366 70 20 CGID Cc1nc2ccccn2c1CN1[C@@H](C)CCC[C@@H]1C 159774850 FMNUPIAZWZPQGI-STQMWFEESA-N 257.381 3.406 70 20 CGID C[C@H](NC[C@H]1CCCC[C@@H]1O)c1cc(F)c(F)c(F)c1 160533714 VSDJBDBUBOBFBQ-RBZYPMLTSA-N 287.325 3.306 70 20 CGID C/C(=C/C(C)(C)C)C(=O)Nc1cccc(S(=O)(=O)F)c1 809282286 BMZMZOZBNZQFKN-KTKRTIGZSA-N 299.367 3.276 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@@H](C)n1nc(C)cc1C 161067745 DVODQKSUGBSQLJ-OAGGEKHMSA-N 291.439 3.488 70 20 CGID CCOCCC1(C(=O)NCCc2ccccc2C)CCC1 160655992 LHQFUXPVWHHITB-UHFFFAOYSA-N 289.419 3.251 70 20 CGID CCC[C@H]1SCCN1C(=O)c1cc(C)c(C)o1 160895121 VKSUJZIOACIYLJ-GFCCVEGCSA-N 253.367 3.212 70 20 CGID Cc1ncc([C@H](C)NC[C@@H]2CCc3ccccc32)c(C)n1 160970766 LJTANHGQIMEIGJ-LRDDRELGSA-N 281.403 3.474 70 20 CGID CN(CCOCc1ccccc1)C(=O)C[C@@H]1C=CCC1 159433971 CPNXYUJZENWGKQ-OAHLLOKOSA-N 273.376 3.018 70 20 CGID O=C(CCC1CCOCC1)N[C@@H]1CCCc2sccc21 159849820 FCSMTDRCNKCZHQ-CQSZACIVSA-N 293.432 3.449 70 20 CGID C[C@H](N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1ccc(F)cc1 159847771 JHERMPTXLPSZCT-QOWREQOWSA-N 263.356 3.290 70 20 CGID CCCn1nccc1CN[C@H](C)c1ccccc1C 159979240 LVRCEDBOHOOJOG-CQSZACIVSA-N 257.381 3.452 70 20 CGID Cc1cccc([C@H]2CCCN2Cc2csc(C)n2)n1 159803581 XHNSMMIPBSVALC-OAHLLOKOSA-N 273.405 3.492 70 20 CGID C[C@@H](c1cccc(C(F)(F)F)c1)S(=O)(=O)Cl 88251558 YSVMNOIWZBGJTF-LURJTMIESA-N 272.675 3.335 70 20 CGID CC(C)(C)NC(=O)NCC1(Cc2ccccc2)CC1 161143471 UFJAWIQJUASELM-UHFFFAOYSA-N 260.381 3.107 70 20 CGID CCO[C@@H]1C[C@@H](N[C@@H](C)C2CCOCC2)C1(CC)CC 161319950 FEPRIGWIABDATH-NUEKZKHPSA-N 283.456 3.375 70 20 CGID CC(C)c1nc(CSc2ncnc3[nH]cnc23)cs1 161333539 KQRFEVNAJAPJRM-UHFFFAOYSA-N 291.405 3.225 70 20 CGID Cc1ccc(NC(=O)NCCc2ccc(F)cc2C)cn1 161426948 UIVRBKPCQSBVTO-UHFFFAOYSA-N 287.338 3.202 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)c3ccco3)c2C)o1 161483939 LGOGTCGCMNICHM-UHFFFAOYSA-N 271.276 3.132 70 20 CGID C[C@@H](N[C@H](C)C1CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 160114459 AMIFLALTFUEZQU-GHMZBOCLSA-N 272.392 3.365 70 20 CGID O=C(NCCCCOc1ccc(F)cc1)C1=CCCC1 160165839 PPKAFJZCTIXTQU-UHFFFAOYSA-N 277.339 3.211 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)c1cc(F)cc(Cl)c1O 160406879 XNDWWQSENSFXLM-OCAPTIKFSA-N 271.719 3.198 70 20 CGID C[C@@H](NC[C@H](C1CCCCC1)N(C)C)c1ccco1 160415905 KDDYVOPJAXXMKB-UKRRQHHQSA-N 264.413 3.441 70 20 CGID CC(C)CN1CCC[C@@H]1CNC(=O)c1ccc2cc[nH]c2c1 160567549 SHZUMUIRYKTTOP-MRXNPFEDSA-N 299.418 3.018 70 20 CGID Cc1csc(CNC(=O)[C@@H]2C[C@H]2c2sccc2C)n1 160618199 PSHNPCHFWILVPO-GHMZBOCLSA-N 292.429 3.241 70 20 CGID C[C@@H]1CCC[C@@H](CNC(=O)c2ccc(CN(C)C)cc2)C1 160980234 WFKYAOFPZVPQEM-GDBMZVCRSA-N 288.435 3.304 70 20 CGID Cc1nccc(NC(=O)N[C@H]2CCOC(C)(C)C2)c1Cl 159425436 PBXTVYYRBRJUDK-JTQLQIEISA-N 297.786 3.123 70 20 CGID CCCC[C@H](CC)CNC(=O)[C@H]1CCC(=O)C[C@@H]1C 159670869 PIJFQLPDQWZBQR-YDHLFZDLSA-N 267.413 3.324 70 20 CGID Cc1cscc1NC(=O)Nc1ccnn1C(C)C 159883319 HBSVXKYWIVUFAE-UHFFFAOYSA-N 264.354 3.478 70 20 CGID CCOc1cccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 159493686 JSKLNQKMMYOZLF-ULQDDVLXSA-N 287.403 3.133 70 20 CGID C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@H]1CCCSC1 159518122 JKPFASMPMGFWKO-FZMZJTMJSA-N 296.411 3.028 70 20 CGID CC[C@@H](C)OCC(=O)N(Cc1ccccc1OC)C1CC1 159530466 ZDPBCSOLQZDBQY-CYBMUJFWSA-N 291.391 3.001 70 20 CGID O=C(N[C@@H]1CCCc2sccc21)[C@H]1Cc2ccccc2O1 159957889 DICUEQOGWOHDTB-UKRRQHHQSA-N 299.395 3.245 70 20 CGID c1ccc(CCCCN[C@@H]2CCN3CCC[C@@H]3C2)cc1 159898162 MBDZQJDRLZVXAV-QZTJIDSGSA-N 272.436 3.226 70 20 CGID O[C@H](CNCc1cc(F)cc(Cl)c1)c1ccccc1 160832194 TYNAXOBDYFBHJQ-OAHLLOKOSA-N 279.742 3.302 70 20 CGID O=C(CNc1ccccc1)N[C@H]1C[C@H]1C1CCCCC1 161065945 KWPAXILKCWTPSX-HOTGVXAUSA-N 272.392 3.184 70 20 CGID CC[C@H](NC(=O)C(F)(F)F)c1ccc(F)cc1F 217847829 ABFORORTDMCWJG-VIFPVBQESA-N 267.197 3.094 70 20 CGID CC(C)Oc1ccc(NC(=O)N(C)[C@@H]2CCSC2)cc1 161137041 DIMALUIZZNVNFW-CYBMUJFWSA-N 294.420 3.443 70 20 CGID CC(C)C[C@H](C)NC(=O)c1csc([C@@H]2CCCO2)n1 161353367 ZILDEYNVVHXQLN-JQWIXIFHSA-N 282.409 3.159 70 20 CGID CC(C)CCO[C@H](C)C(=O)Nc1cccc(OCCF)c1 160468696 GHYMLORNPUETHA-CYBMUJFWSA-N 297.370 3.425 70 20 CGID CCC(CC)n1nc(C)cc1C(=O)Nc1cccc(F)n1 160574552 CQDFSYNSCRVWGC-UHFFFAOYSA-N 290.342 3.339 70 20 CGID CS[C@@H](C)CNC(=O)Nc1ccc(Cl)c(F)c1 160615264 XSSYLFVPGOYYAF-ZETCQYMHSA-N 276.764 3.352 70 20 CGID Cc1c(C(=O)NC[C@H]2CCC[C@H](C)C2)cnn1CC(C)C 160896498 QXBOVYLPRCMPTG-ZFWWWQNUSA-N 291.439 3.404 70 20 CGID CC[C@@]1(C)CCCN(C(=O)NCC2(CCOC)CC2)C1 160976811 RFVPXMDCIVOZGN-HNNXBMFYSA-N 282.428 3.025 70 20 CGID CCC(C)(CC)C(=O)N1CCC[C@@H](C(C)(C)C(=O)OC)C1 159421306 XHQBRORODWRTTA-CYBMUJFWSA-N 297.439 3.251 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc2[nH]ccc2c1 159930602 YSGZQSCCOMLZNI-HNNXBMFYSA-N 298.386 3.390 70 20 CGID Cc1noc(C)c1N(C)C(=O)Nc1cccc2[nH]ccc12 159398801 MVRQDONOGHOSNL-UHFFFAOYSA-N 284.319 3.441 70 20 CGID CC1(C)CC[C@H](COC(=O)c2ccc(Cl)cc2N)O1 160779241 DPUMUTMIBDGZCO-SNVBAGLBSA-N 283.755 3.037 70 20 CGID CCOC(=O)CCCN(C)[C@H](C)c1ccc(F)cc1 160958126 WKWLMSJMJIVEEM-GFCCVEGCSA-N 267.344 3.162 70 20 CGID CC1CCC(NC(=O)[C@H](C)N[C@H]2CCCC[C@@H]2C)CC1 218720541 LDUUURGAHNAECK-ABSNHQIMSA-N 280.456 3.238 70 20 CGID CN(C)[C@@H]1CCC[C@H](N[C@@H]2CCc3ccc(F)cc32)C1 161080309 UYVVPMKYYKJZCN-ZMSDIMECSA-N 276.399 3.275 70 20 CGID CCC(C)(C)CC(=O)Nc1ccc(S(=O)(=O)F)cc1 776368221 RFOPPAZVCQSZOV-UHFFFAOYSA-N 287.356 3.110 70 20 CGID CC(C)N1CCC(NCc2cccc3cc[nH]c23)CC1 218078800 GRTVKYPNTLAUOX-UHFFFAOYSA-N 271.408 3.130 70 20 CGID C[C@H]1CCC[C@@H](CNCc2cn3ccccc3n2)C1 218237437 VOCDKRXHKMFZDT-UONOGXRCSA-N 257.381 3.250 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@]2(C)CC)n1 161023803 HJNGKCOFPMYWRT-YVEFUNNKSA-N 298.390 3.409 70 20 CGID CCc1ccccc1NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 161109737 UULRWTROGHLHBR-GDBMZVCRSA-N 288.391 3.328 70 20 CGID CCC[C@@H]1[C@@H](C)CCCN1C(=O)NCC1(CCOC)CC1 161125748 LPJYTAJFIVJLIP-LSDHHAIUSA-N 296.455 3.413 70 20 CGID C[C@H](NC(=O)[C@H]1CCCCO1)c1ccc(Cl)s1 161201316 MXAUGWIKYPLPIW-DTWKUNHWSA-N 273.785 3.148 70 20 CGID Fc1ccc2oc(N[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)nc2c1 160101687 VDERYIGYLGLVMW-HONMWMINSA-N 288.322 3.336 70 20 CGID CCC(CC)CN(CC)C(=O)c1c(C)nsc1NC 160212951 MAGGQNIHYCJXLP-UHFFFAOYSA-N 283.441 3.392 70 20 CGID CCn1cc([C@@H](C)NC[C@H](C2CCCCC2)N(C)C)cn1 160389815 CZBUOVKLKNHOGS-RHSMWYFYSA-N 292.471 3.064 70 20 CGID CCC(=O)c1cccc(NC(=O)[C@@H]2CCCCN2CC)c1 160754931 LYDKPUBPYRIDDS-HNNXBMFYSA-N 288.391 3.092 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CCOC(C)C 160814837 UTCBKFBCDHILBO-KGLIPLIRSA-N 255.402 3.229 70 20 CGID Cc1cc(C)cc(-c2cc(NC(=O)[C@@H]3CC[C@H](C)O3)[nH]n2)c1 159696440 SOHUMAZBMLTTCB-WFASDCNBSA-N 299.374 3.200 70 20 CGID CO[C@H]1CCC[C@@H](NCc2cccc3cccnc23)C1 159436037 YVDCCJKIBQXXMM-CVEARBPZSA-N 270.376 3.282 70 20 CGID Nc1ccc2c(c1)CCC[C@H]2Nc1nc(C2CC2)ns1 159502105 FNTJKJDUSLIFAA-CYBMUJFWSA-N 286.404 3.487 70 20 CGID Cc1ccccc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 159561271 XAIJZGSBURXJEG-XHSDSOJGSA-N 257.377 3.042 70 20 CGID CCCCC1CCC(C(=O)N(CC)CCCO)CC1 160498747 SVLYBZPDVPYDRP-UHFFFAOYSA-N 269.429 3.214 70 20 CGID c1ccc2c(CN[C@H]3CCN4CCCC[C@H]34)coc2c1 161076195 NVGGOEVAHMHQGO-JKSUJKDBSA-N 270.376 3.149 70 20 CGID CCOc1ccc(CNC(=O)N[C@@H]2CCCC[C@H]2C)cc1 217300899 RJVYGKNJHYHWQK-CZUORRHYSA-N 290.407 3.463 70 20 CGID CC[C@@H](C)CCC(=O)Nc1ccc(S(=O)(=O)F)cc1 808730652 JFRVVKGYISLJPZ-SNVBAGLBSA-N 287.356 3.110 70 20 CGID CCc1noc(C)c1CSCc1nc([C@H](C)OC)no1 159825368 VLODCDOFOTYVGC-VIFPVBQESA-N 297.380 3.069 70 20 CGID C[C@@H]1CCC[C@H](CNC(=O)NCc2ccccc2)C1 218047705 DJJQJBKFYGCRFX-HIFRSBDPSA-N 260.381 3.312 70 20 CGID COc1ccc(C(=O)NC[C@H]2CCC[C@H](C)C2)c(F)c1 218013186 IVVYEKHNZMJJPU-RYUDHWBXSA-N 279.355 3.390 70 20 CGID CCCCN(CC)C(=O)c1c(C)nn(CCC)c1C 161286293 QMZQDRLLHJALGU-UHFFFAOYSA-N 265.401 3.172 70 20 CGID Cc1nc(COC(=O)CC[C@H]2CCCCO2)c(C)s1 161294145 PIBLRCWIAHLPII-GFCCVEGCSA-N 283.393 3.152 70 20 CGID CC[C@H](NC(=O)c1cc(C)ncn1)c1ccc(Cl)cc1 161359970 UFGJKGYCUCUHMH-ZDUSSCGKSA-N 289.766 3.320 70 20 CGID CSc1ccc([C@H](C)NC2CCN(C)CC2)cc1F 161455951 BQYFXAGRPURUCV-NSHDSACASA-N 282.428 3.292 70 20 CGID CC(C)Oc1ccccc1CNC(=O)[C@@H]1CC1(C)C 160029651 FQGYHXCDXDTYMZ-ZDUSSCGKSA-N 261.365 3.136 70 20 CGID CC[C@@H](NCc1ccc(OC(C)C)nc1)C(C)C 160082657 INSPMDUPHPQQKD-CQSZACIVSA-N 250.386 3.393 70 20 CGID C[C@@H]1CC(=O)CC[C@@H]1C(=O)N[C@@H]1CCCc2ccccc21 160370930 NJLGQMGMEFDUKT-ISTRZQFTSA-N 285.387 3.186 70 20 CGID O=C(Oc1cccc(F)c1)c1csc([C@H]2CCCO2)n1 160497390 DHLVYMNBGJNSEJ-GFCCVEGCSA-N 293.319 3.353 70 20 CGID O=C(c1cccs1)N1CC=C(C(F)(F)F)CC1 160577206 YUANABBPUZTYRG-UHFFFAOYSA-N 261.268 3.083 70 20 CGID CCc1nc(CN[C@H](CC)C(C)(C)c2ccccc2)n[nH]1 160625599 YUCFMCCFPHYRLW-CQSZACIVSA-N 286.423 3.213 70 20 CGID CC(C)NC(=O)CN[C@@H](C)c1ccc(SC(C)C)cc1 160966104 OGPJIWBEKNMGJU-ZDUSSCGKSA-N 294.464 3.362 70 20 CGID COCCC(=O)O[C@H](C)c1ccc(F)c(C(F)(F)F)c1 159475216 IVCZZYJFDMEERY-MRVPVSSYSA-N 294.244 3.485 70 20 CGID CCCCO[C@H](C)C(=O)N[C@@H]1CCc2c(OC)cccc21 159887282 NFUBKOAQLRWTKX-IUODEOHRSA-N 291.391 3.004 70 20 CGID Cc1c(CNC2CCC(C(C)(C)C)CC2)cnn1C 161306028 XHXGJWTYMHOQKU-UHFFFAOYSA-N 263.429 3.423 70 20 CGID Cc1cccc(C(=O)Nc2nc3ccccc3[nH]2)c1F 161388589 PZXSJIBKJRZRGM-UHFFFAOYSA-N 269.279 3.263 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1ccc2c(c1)CCC2 217634213 OEOFXZWPOKCVHF-KYNGSXCRSA-N 284.447 3.453 70 20 CGID C[C@H](NC(=O)[C@@H]1CCCN1C1CCCC1)c1ccccc1 217937240 VVELMJUFCUENGZ-YOEHRIQHSA-N 286.419 3.271 70 20 CGID COc1cccc(CCNc2ncnc3c2CCCC3)c1 217801149 CHEIENGMTILXKT-UHFFFAOYSA-N 283.375 3.019 70 20 CGID CC(C)CC(=O)N1CCOc2cc(Br)ccc21 217258149 KMZDWMZPZWPDRD-UHFFFAOYSA-N 298.180 3.221 70 20 CGID CCCOc1cccc(NC2CCC(NC(C)=O)CC2)c1 161088158 WNSCITOLOIWEGE-UHFFFAOYSA-N 290.407 3.335 70 20 CGID CCc1ccccc1C(=O)NCCCOCC(C)C 161190471 AURUQISFEJJBCD-UHFFFAOYSA-N 263.381 3.042 70 20 CGID C[C@H](NC(=O)NO[C@H]1CCCCO1)c1ccc(Cl)cc1 161242422 AUFWWWATRQGQTR-GWCFXTLKSA-N 298.770 3.158 70 20 CGID CS[C@H](C)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1 161338498 GWOKMUVICQSLNY-MNOVXSKESA-N 299.823 3.071 70 20 CGID Cc1ccc(-c2n[nH]c(NC(=O)CC3CC3)c2C)o1 161397880 QNCIOVTVPWDINC-UHFFFAOYSA-N 259.309 3.025 70 20 CGID CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1CCCCO1 160041756 LWKANWQVMUAZRC-LLVKDONJSA-N 287.812 3.319 70 20 CGID O=C(COc1ccc2[nH]ccc2c1)NCC1CCCCC1 160045000 OSYFUDLVGYRLDN-UHFFFAOYSA-N 286.375 3.243 70 20 CGID Cc1cc(NC[C@@](C)(O)c2ccccc2Cl)nc(C)n1 160149974 VVYZFMQAEGRTCA-OAHLLOKOSA-N 291.782 3.066 70 20 CGID Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cc(C)c(C)cc1C)CC2 160555759 FCJZLQSKWLULOW-GOEBONIOSA-N 298.434 3.177 70 20 CGID CCCC1(CNC(=O)[C@](C)(OC)c2ccccc2)CC1 160617504 GXRJZFSEKGUGTQ-MRXNPFEDSA-N 275.392 3.245 70 20 CGID CS[C@@H](C)CC(=O)N1CCC[C@H]1C1CCCC1 160708892 KVNFTQQEKFCGSY-AAEUAGOBSA-N 255.427 3.309 70 20 CGID O=C(Nc1nc2cc(Cl)ccc2s1)[C@@H]1CCCCO1 160715600 STNZFRAWWUANBG-JTQLQIEISA-N 296.779 3.457 70 20 CGID C[C@]1(O)CCCN(C(=O)Nc2cccc(C(F)F)c2)C1 160854523 OSNYNZVQQONZBO-AWEZNQCLSA-N 284.306 3.003 70 20 CGID C[C@@H](SCCCCS(C)(=O)=O)c1ccccc1F 160931253 NJZDCQSYRSHEEB-LLVKDONJSA-N 290.425 3.445 70 20 CGID CCCCn1ncc(C(=O)N2CCCC[C@H]2C)c1C 159626695 UGYKLHNPZDBCRP-GFCCVEGCSA-N 263.385 3.006 70 20 CGID CCOc1ccccc1N(C)Cc1nc(C)c(C)o1 159435883 KKYJMVHKYIEZIO-UHFFFAOYSA-N 260.337 3.327 70 20 CGID Cc1cc(F)ccc1C(=O)N[C@@H](C)Cc1ccc(O)cc1 159444878 QEROWEAIMHJPBT-LBPRGKRZSA-N 287.334 3.201 70 20 CGID CCS[C@@H]1CCC[C@@H](N[C@@H]2CCCc3c2cnn3C)C1 159452040 NXOHMMIVWODTET-UMVBOHGHSA-N 293.480 3.451 70 20 CGID CN(C(=O)Nc1cccc2ccccc12)[C@@H](CN)C1CC1 159906226 VOLHBEZPHWGMGH-INIZCTEOSA-N 283.375 3.041 70 20 CGID C[C@@H](NC[C@@H](C)N1CCc2ccccc21)c1cncc(F)c1 159931295 VWKAXVVKHJLULF-ZIAGYGMSSA-N 299.393 3.323 70 20 CGID CCN(CC)C[C@H]1CCN(c2nc(C(C)(C)C)ns2)C1 159745877 GQXGPQMQWARZMJ-GFCCVEGCSA-N 296.484 3.004 70 20 CGID CCSCC[C@@H](C)Nc1ncnc(CC)c1F 218051906 OPBIJAOCNCBINL-SECBINFHSA-N 257.378 3.122 70 20 CGID CC[C@@H](NCCCNC(=O)C(C)C)c1ccc(F)cc1 159982198 SNGWEZVIXUDTMB-OAHLLOKOSA-N 280.387 3.029 70 20 CGID Cc1cc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)nc(C)n1 160212835 SJPKGPYFKXHQQB-GUYCJALGSA-N 296.418 3.026 70 20 CGID CC[C@H](C)c1ccc(OCC(=O)N(CC)CC)cc1 217342321 ALMUANMQICTGNJ-ZDUSSCGKSA-N 263.381 3.447 70 20 CGID COC[C@@H](NC(=O)Nc1cc(F)cc(Cl)c1)C1CC1 161077392 MPZZEMCUAZFQBB-GFCCVEGCSA-N 286.734 3.026 70 20 CGID CCCn1nc(C)c(C(=O)Nc2ccccc2C)c1C 161138612 FRCBIADBVYSXBI-UHFFFAOYSA-N 271.364 3.471 70 20 CGID CCCN(C(=O)CC(C)C)[C@@H](C)C(=O)Nc1ccccc1 161444984 YHDIAZUSVNQOEG-AWEZNQCLSA-N 290.407 3.298 70 20 CGID O=C(COc1ccc(F)cc1Cl)NCC1(C2CC2)CC1 160217797 JAPCEIHIPNSYDN-UHFFFAOYSA-N 297.757 3.164 70 20 CGID CCOC(=O)C[C@@H](C)NC(=O)C[C@@H](CC)c1ccccc1 160415175 KHMFOICAQJEJKR-ZIAGYGMSSA-N 291.391 3.028 70 20 CGID CCc1oc(C(=O)NC[C@H]2CCCN2CC(C)C)cc1C 160458562 BDPGZUYQDDTFOG-CQSZACIVSA-N 292.423 3.001 70 20 CGID CN(Cc1ccc([S@@](C)=O)cc1)Cc1cccs1 160613078 COTGCAWSMLVMFA-SFHVURJKSA-N 279.430 3.118 70 20 CGID CC1(C)C[C@H](Nc2ncnc3cc(F)c(F)cc23)CCO1 160676344 QJSMIAJHJWCRPV-SECBINFHSA-N 293.317 3.278 70 20 CGID C[C@@H](NC(=O)[C@H]1CCCCO1)c1ccc(OC(F)F)cc1 160863018 BMENNNVMGJNFSZ-ZWNOBZJWSA-N 299.317 3.034 70 20 CGID COc1ccc([C@@H](C)NC[C@@H]2CCC(C)(C)O2)cc1 160310377 WITLAQFFODSSDJ-DOMZBBRYSA-N 263.381 3.303 70 20 CGID CN(CC(C)(C)CN)C(=O)c1cc2ccc(F)cc2s1 161213509 KAAUAMPMXMNSHF-UHFFFAOYSA-N 294.395 3.097 70 20 CGID CCc1ncnc(N[C@@H](C)COc2ccc(C)cc2)c1F 217992764 LUWKLNBSEDVUCW-LBPRGKRZSA-N 289.354 3.366 70 20 CGID CCSCCN1CCC(OC2CCCC2)CC1 159976700 UYYHPIDHSNEVPD-UHFFFAOYSA-N 257.443 3.163 70 20 CGID CC(C)CC[C@H](C)NC(=O)c1ccnc(Cl)c1F 161287135 CXIGRMNUCPEHKI-VIFPVBQESA-N 272.751 3.429 70 20 CGID CC(C)Cc1ccc(CNC[C@@H](C)N(C)C2CC2)cc1 217578782 ANLYKVWEUABGCQ-OAHLLOKOSA-N 274.452 3.457 70 20 CGID COc1ccc(O)c(C(=O)N2CCC[C@H](CC(C)C)C2)c1 161052062 FCVCOCKRSAFIMU-CYBMUJFWSA-N 291.391 3.299 70 20 CGID Cc1ccc(Cl)c(O[C@H](C)C(=O)NC2CC=CC2)c1 161066540 HOYJRQBGIHOZGM-LLVKDONJSA-N 279.767 3.251 70 20 CGID C[C@@H]1CN(C(=O)C(C)(C)C2CCCC2)CC(C)(C)O1 161232108 JRMIDPJNCXJNFP-GFCCVEGCSA-N 267.413 3.229 70 20 CGID CC[C@H](C)NC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 160183377 KEUYOCIZPICODZ-GVXVVHGQSA-N 282.409 3.018 70 20 CGID CCCn1nccc1CNCc1cccc2cccnc12 160184774 DGCVILGCQKWOLD-UHFFFAOYSA-N 280.375 3.131 70 20 CGID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(F)c(NC(C)=O)c1 160840738 UIYDUMRSQZCKBN-NHYWBVRUSA-N 278.327 3.159 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(C(=O)OC)c(F)cc1F 160845490 BTFGUUUVOVWSMT-PSLIRLAXSA-N 297.301 3.126 70 20 CGID CCCn1c(C)nnc1CN1CC[C@@H](c2ccccc2)[C@@H]1C 160911931 MBXCMGGBINHDMM-WMLDXEAASA-N 298.434 3.375 70 20 CGID Cc1ncc([C@H](C)NC[C@H]2CCc3ccccc32)c(C)n1 160971002 LJTANHGQIMEIGJ-BLLLJJGKSA-N 281.403 3.474 70 20 CGID Cc1cc(C(=O)N2C[C@H](C)CSc3ccccc32)on1 159486936 BZYTWZONIOZKHH-JTQLQIEISA-N 288.372 3.372 70 20 CGID CCOc1cccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159493840 JSKLNQKMMYOZLF-ZACQAIPSSA-N 287.403 3.133 70 20 CGID Cc1cccc(OCCC(=O)NCC2(C3CC3)CC2)c1 159696921 QMQYXYCQGWPUJX-UHFFFAOYSA-N 273.376 3.070 70 20 CGID CC[C@H]1CN(C(=O)Nc2ccnc(C)c2Cl)C[C@@H](C)O1 159902871 VYMIOFCHMHCWHP-KOLCDFICSA-N 297.786 3.075 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1 159919137 UFYXFMDTNPQFAM-CQSZACIVSA-N 277.339 3.047 70 20 CGID COCCC1(C(=O)NC2CCC(OC(C)C)CC2)CCC1 159570564 OJRHYZCFTLUTRY-UHFFFAOYSA-N 297.439 3.046 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 159772652 PEJQPCWNULNQJX-KFWWJZLASA-N 293.794 3.336 70 20 CGID CSc1ccccc1N[C@@H](C)CCn1cccn1 159391908 VGRKDGTYMPXRTM-LBPRGKRZSA-N 261.394 3.496 70 20 CGID CC[C@H](NC1CCN(C2CCCC2)CC1)C1CC1 160505868 IGTDIQQITRRAMC-INIZCTEOSA-N 250.430 3.172 70 20 CGID CCC(CC)CNC(=O)N(C)[C@@H](C)CCSC 160574190 VVRLKMNYIOERSV-NSHDSACASA-N 260.447 3.206 70 20 CGID CN(CCc1cccs1)C(=O)N1CCCCCC1 160675496 NKTFTAQITUVLQL-UHFFFAOYSA-N 266.410 3.218 70 20 CGID CCC(=CC(=O)Nc1ccc(S(=O)(=O)F)cc1)CC 776363744 MYJFOKWRLCUPQS-UHFFFAOYSA-N 285.340 3.030 70 20 CGID Cc1ccc(OCCCNC(=O)Nc2ccc(C)nc2)cc1 161361912 RNANFTOCBDWULB-UHFFFAOYSA-N 299.374 3.289 70 20 CGID Cc1nc(NC(=O)Cc2ccc(C)s2)cc(C2CC2)n1 160067231 PJSHOGYQSDSBRS-UHFFFAOYSA-N 287.388 3.214 70 20 CGID CC[C@@H](C)OCC(=O)N[C@@H]1CCCc2sccc21 160125087 WHIPVJWPVCTWDZ-ZYHUDNBSSA-N 267.394 3.057 70 20 CGID O=C(CCOc1cccc(Cl)c1)NCC1(C2CC2)CC1 160137965 LZTPMXVBBDAYFI-UHFFFAOYSA-N 293.794 3.415 70 20 CGID CCC(CC)c1nnc(NC(=O)CO[C@H](C)CC)s1 160354864 OWAHUZJNSXRGEA-SECBINFHSA-N 285.413 3.195 70 20 CGID C[C@H](NC[C@@H]1CCCC[C@@H]1O)[C@H](C)c1ccccc1 160489290 DGRDXXGYDLLMOM-OTRWWLKZSA-N 261.409 3.319 70 20 CGID CCOCCC1(C(=O)N2CCc3ccccc3C2)CCC1 160552138 IFZBKVKHQPLCBQ-UHFFFAOYSA-N 287.403 3.168 70 20 CGID CC[C@H](C)[C@H](C)N[C@@H](CN1CCCC1=O)c1ccccc1 160661012 IFEFSYCIZQCZMC-ZOBUZTSGSA-N 288.435 3.374 70 20 CGID CC[C@@H](NC(=O)c1cc(F)ccc1F)c1c(C)noc1C 160680389 VRUOCTFNRKUEGN-CYBMUJFWSA-N 294.301 3.451 70 20 CGID c1ccc2cc(NCc3nnc4n3CCCC4)ccc2c1 217318050 TVNOUOKTFXIQOM-UHFFFAOYSA-N 278.359 3.380 70 20 CGID CCCCN(CC)c1ccncc1Br 159949899 RBJXXUPGEYFRKV-UHFFFAOYSA-N 257.175 3.471 70 20 CGID CC[C@@H](C)CN(C)c1ccncc1Br 159952800 SYTOAQBSOJDCDW-SECBINFHSA-N 257.175 3.326 70 20 CGID C[C@H]1SCCN(c2nc(C(C)(C)C)ns2)[C@@H]1C 159550197 DLGCYTNTLMPQPM-RKDXNWHRSA-N 271.455 3.166 70 20 CGID CCO[C@@H]1C[C@H](NCc2cccc3[nH]ccc23)C1(C)C 217891942 TXMZMXBRQFJCLE-JKSUJKDBSA-N 272.392 3.461 70 20 CGID CCCC[C@H](CC)CC(=O)N1CCC(CNCC)CC1 161055376 IZMIXVURCHXZBV-HNNXBMFYSA-N 282.472 3.441 70 20 CGID CCO[C@H]1C[C@@H](N[C@@H](CC)c2cnn(C)c2)C1(CC)CC 161291576 RUYHKXVJQVEZOE-XHSDSOJGSA-N 293.455 3.445 70 20 CGID Cc1cnc(C(=O)Nc2scnc2-c2ccccc2)cn1 161408964 IUYILAUEBRTUPJ-UHFFFAOYSA-N 296.355 3.161 70 20 CGID C[C@H]1CCC[C@@H](C)N1C(=O)Cc1cc(F)c(F)cc1F 160222352 MVUKGURKYDZCTC-AOOOYVTPSA-N 285.309 3.436 70 20 CGID CCOCCC1(CNC(=O)N[C@H](C)CC(C)C)CCC1 160630098 YCZDRZNNAVFCGM-CQSZACIVSA-N 284.444 3.317 70 20 CGID CN(C)[C@H](CNC(=O)NCCCC(C)(C)C)c1ccco1 160907789 VRLRWRZQMVHADM-CYBMUJFWSA-N 295.427 3.008 70 20 CGID C[C@@H](NC(=O)Nc1ccccc1-n1cccn1)C1CCC1 160950905 UDGOEIPEAJUNHA-GFCCVEGCSA-N 284.363 3.182 70 20 CGID CCn1cc([C@@H](C)NC[C@@H]2CCc3ccccc32)cn1 160981788 ZWYVQYHCWZRUMX-HIFRSBDPSA-N 269.392 3.284 70 20 CGID CC(C)CCn1ccc(N[C@@H](C)c2cccnc2)n1 159899591 GVGLGPZQUUDVRX-ZDUSSCGKSA-N 258.369 3.497 70 20 CGID Cc1cc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)oc1C 159509987 LTYGLKSSWLQOFO-CYBMUJFWSA-N 277.364 3.118 70 20 CGID C[C@@H]1CSc2ccccc2N(C(=O)[C@H]2CCCOC2)C1 159523887 ZEFVKPLSXJYRNV-STQMWFEESA-N 291.416 3.188 70 20 CGID Cc1cc(C(=O)NCCc2ccco2)cc(C)c1F 160556006 DWMQXEBNIONAHQ-UHFFFAOYSA-N 261.296 3.008 70 20 CGID CCOC(C)(C)CNc1ncccc1Br 159506834 SKSFDBKQPAFOFK-UHFFFAOYSA-N 273.174 3.071 70 20 CGID C[C@H]1C[C@@H]1C(=O)Nc1cc(F)c(Br)cc1F 160741850 YCJQPBRYPTZJES-WDSKDSINSA-N 290.107 3.322 70 20 CGID CCO[C@@H](CC)C(=O)N[C@H]1CCCc2sccc21 160145482 IFCHGPRHPFAXBN-RYUDHWBXSA-N 267.394 3.057 70 20 CGID CC[C@@H](N[C@H](C)C(=O)NC(C)(C)C)c1ccc(F)cc1F 161025250 UKMFEVZJVVPEPG-QMTHXVAHSA-N 298.377 3.309 70 20 CGID CCCN(CCO)Cc1ccccc1OC1CCCC1 161198002 CHLQEIMHHFGLGP-UHFFFAOYSA-N 277.408 3.212 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2C2CC2)o1 161207128 IDEWMSKZSOZRCB-ILXRZTDVSA-N 289.375 3.136 70 20 CGID CCC(CC)CNC(=O)N1CCC[C@@H](N2CCCC2)CC1 160549613 PVHJGJCTBSASDG-MRXNPFEDSA-N 295.471 3.083 70 20 CGID CCCS(=O)(=O)N1CCCCC[C@H]1c1ccc(C)o1 160638056 DXBDGRIDRNDOCP-ZDUSSCGKSA-N 285.409 3.245 70 20 CGID Clc1cncc(N[C@H]2CCO[C@H](c3ccccc3)C2)n1 160662297 PRMKPLNLGCXBPA-STQMWFEESA-N 289.766 3.462 70 20 CGID CC[C@H](CC(=O)N(C)Cc1cccn1C)C(C)C 160997997 UXIVSZCWDPDAPF-CYBMUJFWSA-N 250.386 3.056 70 20 CGID O=C(C1[C@@H]2[C@@H]1[C@@H]1CC[C@@H]2C1)N1CCc2c(F)cccc2C1 160998074 RBNHQUQOSZAFSS-XYPYXGAPSA-N 285.362 3.003 70 20 CGID CC[C@H]1CCC[C@@H]1NC(=O)c1cc(C)nc2onc(C)c12 159606599 HVCQRGKDBRISCM-AAEUAGOBSA-N 287.363 3.148 70 20 CGID C[C@@H](CC(=O)NCCCOc1ccccc1)c1ccncc1 159476311 DPFQFWSBXSRWSY-HNNXBMFYSA-N 298.386 3.161 70 20 CGID CN(CC1CCOCC1)C(=O)N[C@@H]1CCCCC1(C)C 159938415 DXYKEXAWCDFILV-CQSZACIVSA-N 282.428 3.023 70 20 CGID COc1cc(CN(C)CCc2ccccc2F)ccc1O 159548783 WGTUAILSXLHKLR-UHFFFAOYSA-N 289.350 3.214 70 20 CGID Cc1ccc(CNC(=O)C(C)(C)C2CCCC2)cn1 159949247 QIZNSSQMNGZYPS-UHFFFAOYSA-N 260.381 3.223 70 20 CGID CCCC[C@H](Nc1cc(C)ncn1)C(=O)OC(C)(C)C 159974230 HPJSLZBPAQPGIU-LBPRGKRZSA-N 279.384 3.097 70 20 CGID Cc1cc(C(=O)N(C)C)c2cc(Br)ccc2n1 159574872 MWDLMKDHUAFGNY-UHFFFAOYSA-N 293.164 3.008 70 20 CGID CC1(C)C[C@@H](NCc2cc3ccccc3o2)CCO1 160462492 LJJXJMMTMKFYRB-ZDUSSCGKSA-N 259.349 3.480 70 20 CGID C[C@H]1CCCC[C@H]1NC(=O)c1c[nH]nc1-c1ccccc1 217141107 ZXNLQWGOVFFGPN-SWLSCSKDSA-N 283.375 3.385 70 20 CGID COCCCCCN1CCC[C@@H]1c1cccc(C)n1 159831388 WOVCQNFMTWUFRW-MRXNPFEDSA-N 262.397 3.344 70 20 CGID CC(C)CCN(CCC(C)C)C(=S)NC1CC1 217760243 JNPJKSASLRXTPR-UHFFFAOYSA-N 256.459 3.418 70 20 CGID CCCOc1ccc(CNCCN(C)[C@H](C)CC)cc1 217375280 LHYKWRRUMUQMFU-OAHLLOKOSA-N 278.440 3.295 70 20 CGID CC1(NC(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)CCC1 161360824 VSGATXSEWCHORE-QWHCGFSZSA-N 282.428 3.070 70 20 CGID CCCCCNC(=O)Nc1ccn(CCC(C)C)n1 161402739 KTMFXNPXGNRXIW-UHFFFAOYSA-N 266.389 3.241 70 20 CGID CC[C@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccccc1 161414540 HZSPUWKXQZLRID-HOCLYGCPSA-N 295.448 3.019 70 20 CGID CC(C)C1CCC(NC(=O)NC2C[C@@H](C)O[C@H](C)C2)CC1 160053212 NPHQHMBDRQGUFT-LMRVLLHPSA-N 296.455 3.456 70 20 CGID Cc1cccc([C@H](C)C(=O)N(C)c2ccc3c(c2)OCO3)c1 160089138 WYETXGHRUQJXEO-ZDUSSCGKSA-N 297.354 3.490 70 20 CGID CCc1ccc([C@H](CO)NC(=O)N[C@@H](C)CC(C)C)cc1 160219563 TYZYSBLDFXIYBL-BBRMVZONSA-N 292.423 3.016 70 20 CGID CCC[C@H](Sc1nncc2ccccc12)C(=O)OCC 160225004 ZYJPIMUHBCAZNN-ZDUSSCGKSA-N 290.388 3.454 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)NCC1(C2CC2)CC1 160236961 VPYMDTXAOSIUBL-YPMHNXCESA-N 250.386 3.055 70 20 CGID O=C(COc1ccccc1)N[C@H]1CCCc2sccc21 160275734 QELWNXSRYATRLS-AWEZNQCLSA-N 287.384 3.321 70 20 CGID CCc1cc(O)nc(CN[C@@H](c2ccccc2)C(C)C)n1 160586304 WCPJKCXBTFCFLI-QGZVFWFLSA-N 285.391 3.232 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@@H](C)C[C@H]1CCCO1 160669773 LWWKABRSQXZODX-WCQYABFASA-N 281.783 3.336 70 20 CGID CC(C)CC(CC(C)C)NC(=O)N(C)C[C@@H]1CCC[C@H]1O 160761949 WIQGTOGWDRHVAQ-GOEBONIOSA-N 298.471 3.250 70 20 CGID COC[C@@H]1CCCN1C(=O)CC1CCC(C)(C)CC1 160889562 XSKNDXBPKIZRGX-AWEZNQCLSA-N 267.413 3.230 70 20 CGID COc1cccc(CCCN2CCC[C@@H](c3ccn[nH]3)C2)c1 159429447 UEGOPLZXMGZRKD-MRXNPFEDSA-N 299.418 3.231 70 20 CGID c1cc2c(cc1CN1CC[C@@H]3CCCC[C@@H]31)OCCO2 159702224 ARNNIEVNGIZGGD-GJZGRUSLSA-N 273.376 3.222 70 20 CGID Cc1ccccc1NC(=O)N[C@@H]1CCOC(C)(C)C1 160654623 XHPFQYOEFXVANA-GFCCVEGCSA-N 262.353 3.074 70 20 CGID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(Cl)ccn1 159578296 GNPWZHJBNOSOMV-KOLCDFICSA-N 252.745 3.044 70 20 CGID C1=CC[C@@H](CN[C@@H]2CCN(Cc3ccccc3)C2)CC1 218572783 VBGZPOZSATUDMU-SJLPKXTDSA-N 270.420 3.207 70 20 CGID CC[C@H](C)c1ccc(OCC(=O)N2CCCC2)cc1 217347776 QCUYDKHDMFSIAB-ZDUSSCGKSA-N 261.365 3.201 70 20 CGID CN(C(=O)C[C@H]1CCCN1)c1ccc(-c2ccccc2)cc1 161083471 OJMOYLYMCUMURU-QGZVFWFLSA-N 294.398 3.459 70 20 CGID C[C@H]1CCC[C@@H](C(=O)NC[C@@H](C)CN2CCCCC2)C1 161212764 RPSIEGSTCSOSFN-ARFHVFGLSA-N 280.456 3.051 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cc(OC)ccc1OC 160066445 SDCMAFMOIBQSFA-KBPBESRZSA-N 294.439 3.085 70 20 CGID CC(C)n1cccc1C(=O)Nc1ccc2c(c1)OCCO2 160428057 TVUNKTGJRKMWAS-UHFFFAOYSA-N 286.331 3.093 70 20 CGID CC1(NC(=O)NCc2ccc(F)c(Cl)c2)CCC1 160473948 PKEUISWMCGCJJY-UHFFFAOYSA-N 270.735 3.221 70 20 CGID Cc1noc(C)c1CNC(=O)NCC1CCC(C)(C)CC1 160572917 RXKORDFGPAVQHH-UHFFFAOYSA-N 293.411 3.307 70 20 CGID CCC(=O)c1cccc(NC(=O)c2ccc3[nH]cnc3c2)c1 160716901 MDWQGQFMNKYAOQ-UHFFFAOYSA-N 293.326 3.408 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cc(NC(C)=O)ccc1F 160929479 PXAWMNPGLNRBSR-XHDPSFHLSA-N 278.327 3.159 70 20 CGID CC(C)Oc1ccccc1NC(=O)N(C)[C@@H]1CCSC1 160972355 XSFOQMULYNLFRY-GFCCVEGCSA-N 294.420 3.443 70 20 CGID Cc1cc(NC(=O)c2c(Cl)cccc2Cl)c[nH]c1=O 159674862 HKWKEQVTIGPXRK-UHFFFAOYSA-N 297.141 3.242 70 20 CGID Cc1ccccc1[C@@H](NC(=O)[C@@H](C)N)[C@H]1CCC[C@H](C)C1 159687983 FOTRFUYDDSBBKO-GUSZCTEKSA-N 288.435 3.326 70 20 CGID CC1CCC(NC(=O)[C@@H](C)Sc2ccncc2)CC1 159882423 NAPMAHULWDBWBL-OTTFEQOBSA-N 278.421 3.257 70 20 CGID O=C(CCc1ccccc1)N[C@H]1CCOC2(CCCC2)C1 159533560 SFQZGUDKYISPOK-INIZCTEOSA-N 287.403 3.227 70 20 CGID COc1ccc(N(C)C(=O)C[C@@H](C)C(C)C)cc1F 159369203 KYPRAFTYHUHDMD-LLVKDONJSA-N 267.344 3.479 70 20 CGID CCCCc1nc(CN(C)c2ccccc2OCC)no1 159381618 WMEQTLDPGGJOLH-UHFFFAOYSA-N 289.379 3.447 70 20 CGID C[C@@H](NCCCN1CCCC1=O)c1cc2ccccc2o1 159577061 WOUHYGCKRMHTRR-CYBMUJFWSA-N 286.375 3.096 70 20 CGID CC[C@@H](NC(=O)Nc1cc(C)cc(C)c1)[C@@H]1CCCO1 159398611 QUDNZIVYFUFTDS-CABCVRRESA-N 276.380 3.383 70 20 CGID COc1cc(NCc2c(C)noc2C)ccc1F 159995506 ZKFNMNVARYNISK-UHFFFAOYSA-N 250.273 3.051 70 20 CGID C[C@@H]1CN(Cc2ccc(C(C)(C)C)cc2)CC[C@@H]1O 159456264 DHFSJQIXIRMVNH-CJNGLKHVSA-N 261.409 3.187 70 20 CGID CC(C)C[C@H](CNCc1cc(F)cc(F)c1)N(C)C 159890208 MMCKEAOYPKBMMH-OAHLLOKOSA-N 270.367 3.031 70 20 CGID CN(CCNCc1cc(F)cc(Cl)c1)C1CCCC1 160937063 LCDKYCXYMLYWPG-UHFFFAOYSA-N 284.806 3.443 70 20 CGID C[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1ccc(F)cc1 218434287 MNVRQPGDIMTAMM-IVMMDQJWSA-N 265.372 3.275 70 20 CGID CCNCC1CCN(C(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)CC1 161015540 NSORJZIBHUDLPX-JKSUJKDBSA-N 292.467 3.073 70 20 CGID CCCNC(=O)[C@H](C)SCc1c(C)cccc1C 161388137 WGHCCQKDORZEHU-ZDUSSCGKSA-N 265.422 3.451 70 20 CGID CC(C)C1(CNC(=O)C[C@@H](C)c2ccncc2)CC1 161434623 URIGHPVTWVQLRP-CYBMUJFWSA-N 260.381 3.128 70 20 CGID CCc1ccc([C@H](C)N[C@@H](CCO)CSC)s1 160409303 LQIXCQWRSPEUQE-QWRGUYRKSA-N 273.467 3.075 70 20 CGID COc1cc(F)ccc1NC(=O)N[C@@H](C)C1CCC1 160541447 KTJDILKYORYUPR-VIFPVBQESA-N 266.316 3.144 70 20 CGID C[C@@H](C(=O)N(C)c1ccc2c(c1)OCO2)c1ccsc1 160567643 VWUSYPLCLOYZLI-SNVBAGLBSA-N 289.356 3.243 70 20 CGID CN(Cc1cccn1C)C(=O)C1(Cc2ccccc2)CC1 160585306 IBVQWUWWNYEWQQ-UHFFFAOYSA-N 282.387 3.006 70 20 CGID C[C@@H](C(=O)Nc1cc(F)ccc1OC(F)F)C1CC1 159460798 SHLIMGRGZAMUHH-SSDOTTSWSA-N 273.254 3.412 70 20 CGID Cc1cc(Cl)ccc1C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]12 159772363 PEJQPCWNULNQJX-RBSFLKMASA-N 293.794 3.336 70 20 CGID CC1(C)C[C@H](Nc2nc(C(C)(C)C)ns2)CCO1 159995858 FTHPXVDFUAHWQV-SECBINFHSA-N 269.414 3.205 70 20 CGID Cc1cc(F)ccc1C(=O)N1CC=C(C(F)(F)F)CC1 160579217 SELOWKFYVAXTSC-UHFFFAOYSA-N 287.256 3.469 70 20 CGID O[C@H](Cn1cnc2c1CCCC2)c1cc2ccccc2o1 216646047 MQHPKRGQXFEVJP-OAHLLOKOSA-N 282.343 3.242 70 20 CGID CC[C@@H](C)Oc1ccc(C(=O)N[C@@H](CO)CC(C)C)cc1 161231897 VGPBAJJJSKCBED-UKRRQHHQSA-N 293.407 3.001 70 20 CGID C[C@H](NC1CCN(CCc2ccc(F)cc2)CC1)C1CC1 160121714 YWAWCFSNHFWLNK-AWEZNQCLSA-N 290.426 3.221 70 20 CGID CC(C)CCOc1ccc(NC(=O)[C@@H]2CCCCN2)cc1 160303777 KGWFTJFFTIFZHG-INIZCTEOSA-N 290.407 3.192 70 20 CGID c1ccc2oc(NCc3nnc(C4CC4)n3C3CC3)nc2c1 160334354 VFOAOHPDNXHLHH-UHFFFAOYSA-N 295.346 3.244 70 20 CGID COc1ccc(Cl)cc1Cn1cnc(C(C)C)cc1=O 160694456 QJSJZACNCVDAIB-UHFFFAOYSA-N 292.766 3.077 70 20 CGID CCN(C(=O)N[C@H]1CCN(C2CCCC2)C1)[C@H](C)C(C)C 160901887 DBUKXXIQKBQLMS-CABCVRRESA-N 295.471 3.079 70 20 CGID CCOc1ccccc1N(C)Cc1noc(C(C)C)n1 159427370 DBDZPKDXBVYNBP-UHFFFAOYSA-N 275.352 3.228 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)Cc1cn(C)c2ccccc12 159637378 AYSRJMNMWAUBCE-CZUORRHYSA-N 284.403 3.416 70 20 CGID Cc1nn(-c2ccccc2)c(C)c1CN[C@H](C)[C@@H]1CCOC1 159836813 GMDYPGQBVSVFAT-CZUORRHYSA-N 299.418 3.004 70 20 CGID Cc1ccccc1[C@@H]1C[C@H](C)N(CCn2ccnc2)C1 159838690 HHKRLIPLENNQRG-JKSUJKDBSA-N 269.392 3.070 70 20 CGID C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@H]1CCCSC1 159533961 GMLRIVQQKPLOHX-FZMZJTMJSA-N 296.411 3.028 70 20 CGID CC[C@@H](C)[C@H](O)CNC(=O)[C@@H](C)Cc1ccccc1Cl 159396210 LONURADEVUUKEF-TYNCELHUSA-N 297.826 3.042 70 20 CGID CC[C@@H](NCCOC[C@H]1CCCO1)c1ccc(F)cc1 160931989 GJDTVMSJFDOIQE-HZPDHXFCSA-N 281.371 3.062 70 20 CGID CC[C@@H](C(=O)N[C@@H]1CCOC(C)(C)C1)c1ccc(F)cc1 161375031 CQTNVBGHSFOCIO-HUUCEWRRSA-N 293.382 3.393 70 20 CGID CC[C@H](C)[C@@H](C)NCc1ccc(OC(C)C)nc1 160039838 GPRJTOSUJBEQEA-QWHCGFSZSA-N 250.386 3.393 70 20 CGID CN(C(=O)CCC1CCCC1)c1ccc2c(c1)OCO2 160376306 CUFXJJCIIMZWEI-UHFFFAOYSA-N 275.348 3.349 70 20 CGID CC(C)(O)CN[C@H]1CCC[C@H]1CCc1ccccc1 160652656 CIKQNZHMZQZUCZ-HOTGVXAUSA-N 261.409 3.148 70 20 CGID O=C(N[C@H]1CCCc2occc21)N1CCC2(CCC2)C1 160670983 QGONWYZTZYKUOL-ZDUSSCGKSA-N 274.364 3.243 70 20 CGID CCC1CCC(CNC(=O)C[C@@H](C)SC)CC1 160674314 UVYOFWPGVSTJBF-PNESKVBLSA-N 257.443 3.461 70 20 CGID CCNC(=O)[C@H](CC)Cc1ccccc1Br 160892596 KFDWKPQMWWSBEP-SNVBAGLBSA-N 284.197 3.154 70 20 CGID CC[C@@H](C)CN(C)CC1CCN(C(=O)C(C)(C)C)CC1 159611343 BWJLUZPRLIQKFT-CQSZACIVSA-N 282.472 3.249 70 20 CGID CC(C)[C@H]1CCCN(C(=O)NCCc2cscn2)CC1 159545271 BZKFYYUNUQZGIP-ZDUSSCGKSA-N 295.452 3.153 70 20 CGID CCC(C)(CC)C(=O)N(C)c1ccc2c(c1)OCO2 159384485 GHORBHVLBCEZRC-UHFFFAOYSA-N 263.337 3.204 70 20 CGID CCNC(=O)C(C)(C)CNc1nc2ccccc2cc1C 161339274 ORTFASDXWBIEOX-UHFFFAOYSA-N 285.391 3.117 70 20 CGID Cc1ccccc1[C@H](C)NC(=O)N[C@H]1C=CCCC1 161345434 NBFDNDTZIRMHDV-KBPBESRZSA-N 258.365 3.464 70 20 CGID CC[C@H](C)N(Cc1ccccc1)C(=O)[C@H]1CCCCO1 160055688 WLMIMYCCVXTGAC-GOEBONIOSA-N 275.392 3.383 70 20 CGID COc1ccc(N(C)C(=O)[C@@H]2C[C@@H]2C2CC2)cc1Cl 160311383 BYPWOMIZQJBPMD-VXGBXAGGSA-N 279.767 3.358 70 20 CGID CCC(C)(CC)NC(=O)c1cc2c(cc1F)NC(=O)CC2 160353840 STKGLTZBHFVHKQ-UHFFFAOYSA-N 292.354 3.019 70 20 CGID C[C@H]1CCN(C(=O)Nc2cnc(C(C)(C)C)nc2)C[C@@H]1C 160382774 ICKBBNAONXQHOU-RYUDHWBXSA-N 290.411 3.284 70 20 CGID Cc1cc2cc([C@@H](C)NCC(C)(C)O)oc2cc1C 160599289 GWSIENCUJZDHBU-GFCCVEGCSA-N 261.365 3.471 70 20 CGID CC[C@H](NC(=O)C[C@H](C)SC)c1c(C)noc1C 160782233 VUXUZDRUWYSTEN-KWQFWETISA-N 270.398 3.000 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc(F)cc1F 159672816 VZKIPOJSIZWGFB-GFCCVEGCSA-N 295.329 3.186 70 20 CGID O=C(NCCc1cc2ccccc2[nH]1)c1cc(Cl)ccn1 159530691 XOEFLCWYCKDJNI-UHFFFAOYSA-N 299.761 3.189 70 20 CGID C[C@H](NCc1ccc(F)c(C(F)(F)F)c1)[C@@H]1CCOC1 160153463 KWMKWXOBHNWMSB-GXSJLCMTSA-N 291.288 3.359 70 20 CGID O=C(NCCc1ccc(O)cc1)NCCC1CCCCC1 217305065 YTWCOUBAONIQHC-UHFFFAOYSA-N 290.407 3.204 70 20 CGID CC1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CCCCC1 864238297 ZNIXCLYLAYPQTE-UHFFFAOYSA-N 299.367 3.254 70 20 CGID CCCCCCNC(=O)c1ccc(OC)cc1F 218443551 HPXVDLMSYUQXLS-UHFFFAOYSA-N 253.317 3.144 70 20 CGID CSc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1 217633262 ZTYFXNHGVLVJPE-HOTGVXAUSA-N 276.449 3.125 70 20 CGID CC[C@H](COC)N[C@@H](c1ccc2c(c1)OCCO2)C(C)C 161040132 BAZSQRFZQCCWPT-RHSMWYFYSA-N 293.407 3.170 70 20 CGID COC(=O)c1cccc(NC(=O)c2cccc(C)c2F)c1 161398482 VBWMHWMJSVXSRR-UHFFFAOYSA-N 287.290 3.173 70 20 CGID c1cc2occc2c(N[C@H]2CCO[C@H](C3CC3)C2)n1 160322544 SVPZOVFSQFHIKI-FZMZJTMJSA-N 258.321 3.197 70 20 CGID FC(F)(F)c1cccnc1N[C@@H]1CCO[C@H](C2CC2)C1 160356365 AQOBADPRMYLILQ-PWSUYJOCSA-N 286.297 3.470 70 20 CGID CCCN1CCC(NCCCCc2nc(C)cs2)CC1 160638719 OMNJSEZALSDROX-UHFFFAOYSA-N 295.496 3.238 70 20 CGID CCOCCC1(C(=O)NCCc2ccc(F)cc2)CCC1 160649279 ZRZIUDROESQJOQ-UHFFFAOYSA-N 293.382 3.081 70 20 CGID CC(C)[C@@H]1CCCC[C@H]1NCCCCN1CCC[C@@H]1CO 160696935 FFMRFNJRHHYRRR-FGTMMUONSA-N 296.499 3.028 70 20 CGID Cc1cccc2c1CC[C@H]2NC(=O)NC1(C)CCC1 160840556 VACDDBNDTDNAAK-CQSZACIVSA-N 258.365 3.224 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)[C@@H]2CC=CCC2)n1 160940392 UEQUEVKHDFVZEP-GFCCVEGCSA-N 296.374 3.329 70 20 CGID C[C@H]1CC(=O)CC[C@H]1c1nc(-c2ccsc2)no1 160993142 WZMSIAXSNAFNGK-GZMMTYOYSA-N 262.334 3.271 70 20 CGID COCCCC(=O)N1C[C@H](C)CSc2ccccc21 159619696 DMFNCFAEHIKYCW-LBPRGKRZSA-N 279.405 3.188 70 20 CGID Cc1ccccc1[C@@H](C)NCC1(C(=O)N(C)C)CCCC1 159624124 RDGATUGYZXVSLU-OAHLLOKOSA-N 288.435 3.294 70 20 CGID CCCCc1nc(CN(C)C[C@H]2CCC[C@@H]2O)cs1 159652413 IKKANQWPSRKAKS-OCCSQVGLSA-N 282.453 3.079 70 20 CGID Cc1ccc(CNCc2ccc(OCC3CC3)nc2)o1 159956623 CUSXVTMLWGCXFG-UHFFFAOYSA-N 272.348 3.062 70 20 CGID CCO[C@@H]1C[C@@H](Nc2ccc(F)c(OC)c2)C1(C)C 160103785 QOBKMTLBXUZRNH-ZIAGYGMSSA-N 267.344 3.450 70 20 CGID CC(C)C[C@H](C)OCC(C)(C)CS(=O)(=O)Cl 114472730 XJTQYTNSBFDPCA-JTQLQIEISA-N 270.822 3.032 70 20 CGID C[C@H]1CCCC[C@@H]1NC(=O)c1c[nH]nc1-c1ccccc1 217141086 ZXNLQWGOVFFGPN-WFASDCNBSA-N 283.375 3.385 70 20 CGID c1ccc2c(c1)CCCN(CCCN1CCCCC1)C2 161007662 SQCZNVDWUYNZOJ-UHFFFAOYSA-N 272.436 3.311 70 20 CGID CCOC(=O)CCCCCn1c(C)nc2c1CCCC2 216821322 CSMLVRXHQVUNQY-UHFFFAOYSA-N 278.396 3.194 70 20 CGID Cc1cccc(C)c1OCCCN[C@@H](C)c1cnn(C)c1 161234969 QMWCDUOKXWRNMR-HNNXBMFYSA-N 287.407 3.157 70 20 CGID CCOc1cccc(NC(=O)N[C@@H](CC)[C@H]2CCCO2)c1 161417100 MCQRDZSSBIAIQS-LSDHHAIUSA-N 292.379 3.164 70 20 CGID CCOC(=O)C[C@H](C)NC(=O)C1(CC(C)C)CCCC1 160085508 WDBWLIURDMBICP-ZDUSSCGKSA-N 283.412 3.051 70 20 CGID CS[C@@H](C)CC(=O)N1CCCc2cc(F)ccc21 160151136 YRLCEKWOZOFFNN-JTQLQIEISA-N 267.369 3.247 70 20 CGID FC(F)(F)c1cccnc1N[C@H]1CCO[C@@H](C2CC2)C1 160356752 AQOBADPRMYLILQ-CMPLNLGQSA-N 286.297 3.470 70 20 CGID COCCC1(CNC(=O)NCC2(C3CC3)CC2)CCCC1 160370993 IJQLBZQQXMVONX-UHFFFAOYSA-N 294.439 3.073 70 20 CGID CCCCNc1ccccc1C(=O)NCCc1ccco1 160555883 BCWXNGWMHDQXBC-UHFFFAOYSA-N 286.375 3.464 70 20 CGID CN(CCC1CC1)C(=O)Nc1cccnc1Br 160585560 RFJSWAYYLXQODG-UHFFFAOYSA-N 298.184 3.108 70 20 CGID CC(C)c1ccc(C(=O)N(C)Cc2cccn2C)cc1 160593062 XPGKOXDOCQUHIC-UHFFFAOYSA-N 270.376 3.421 70 20 CGID CC(C)c1cc(=O)n(Cc2cccc(C(F)(F)F)c2)cn1 160862780 UAIXIGAGQHAQKT-UHFFFAOYSA-N 296.292 3.434 70 20 CGID CCCCn1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c1C 160932825 HZNZRKAJDLQOFU-CHWSQXEVSA-N 277.412 3.110 70 20 CGID C[C@@H](NCCOc1ccc(Cl)cc1)C1CCN(C)CC1 159650183 QQPJCOOLUGVMQU-CYBMUJFWSA-N 296.842 3.039 70 20 CGID Cc1cc(NC(=O)[C@H](C)OC2CCCCCC2)no1 159599512 YIPVNOBHPSDNNY-NSHDSACASA-N 266.341 3.049 70 20 CGID O=C(c1ccc(C(F)(F)F)cn1)N1CCCCCC1 161093965 BLWXPJHMOFEXHE-UHFFFAOYSA-N 272.270 3.117 70 20 CGID O=C(COc1ccc(Cl)cc1)N1[C@H]2C=CC[C@H]1CC2 218700566 SXDSQXPURMWMHG-STQMWFEESA-N 277.751 3.038 70 20 CGID Cc1ccc(NC(=O)N(CCO)Cc2ccccc2)cc1C 217310732 QGIKSXQVBXBVAV-UHFFFAOYSA-N 298.386 3.330 70 20 CGID C[C@@H](NC[C@H]1CCc2ccccc21)C1CCN(C)CC1 161006740 NLCMNHKDHRLWLF-RHSMWYFYSA-N 272.436 3.036 70 20 CGID Cc1cccc(O[C@@H](C)CNC(=O)c2ccc(C)c(N)c2)c1 161166516 QXBXJABYQHJRQR-AWEZNQCLSA-N 298.386 3.083 70 20 CGID CCCCOc1ncccc1CNC(=O)C[C@@H](C)SC 161167335 PTACETKDNPEFRR-GFCCVEGCSA-N 296.436 3.018 70 20 CGID CC1(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CCOCC1 161509923 NNXCRYUYUQHDMA-RRFJBIMHSA-N 279.424 3.278 70 20 CGID CCCCS[C@H](C)C(=O)Nc1cccc(F)n1 160583032 YXTSBJMTNKEGCP-SECBINFHSA-N 256.346 3.081 70 20 CGID Cc1cc(F)cc(NC(=O)N(C)CCC2CC2)c1 160596121 USWZZOUTOZESMW-UHFFFAOYSA-N 250.317 3.398 70 20 CGID CN(Cc1cccn1C)C(=O)CCc1ccc(Cl)cc1 160689337 NHPKPTLLRCPNOM-UHFFFAOYSA-N 290.794 3.270 70 20 CGID CCCCCN(C(=O)N[C@@H]1CCN(CC2CC2)C1)C(C)C 160691204 ZLPQAVOCBUTGQN-MRXNPFEDSA-N 295.471 3.081 70 20 CGID CC1(NC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)CCC1 160695871 HPNYFWUXPQMLFW-GJZGRUSLSA-N 288.391 3.149 70 20 CGID CCCCN(CCCC)C(=O)N[C@H]1CCN(CC2CC2)C1 160741201 KWXAVPBEGFHJBJ-INIZCTEOSA-N 295.471 3.083 70 20 CGID CCOc1cc(C)ccc1N[C@@H](C)CCn1cccn1 159416064 ZRWMPALXTLIXFL-AWEZNQCLSA-N 273.380 3.481 70 20 CGID CC(C)(C)NC(=O)CNC1CC(c2cccc(Cl)c2)C1 159864208 ILOIXXJOKBOLSP-UHFFFAOYSA-N 294.826 3.090 70 20 CGID CC1(C)C[C@H](NCc2cnc(C3CC3)s2)CCO1 160468838 BVBXAOFYSBPBOW-LLVKDONJSA-N 266.410 3.068 70 20 CGID CCC(CC)(CC)NC(=O)c1cccc2[nH]cnc12 159682085 IIXMAPKBPZXYAW-UHFFFAOYSA-N 259.353 3.262 70 20 CGID CC(C)[C@@H](C)NCCC1CCN(CC(F)(F)F)CC1 159972767 IJCBCIQQHYGKDD-GFCCVEGCSA-N 280.378 3.285 70 20 CGID CC[C@@H](C)OCC(=O)N(CC1CCCCC1)C1CC1 159802527 CIHNGXZLEJAOJU-CYBMUJFWSA-N 267.413 3.373 70 20 CGID CCc1ncnc(N[C@H](C)c2ccc(OC)cc2)c1F 217995398 JZYMHKXMQMRGBA-SNVBAGLBSA-N 275.327 3.360 70 20 CGID CC1CCN(C(=O)NC[C@H]2CCC[C@@H](C)C2)CC1 218051261 RFLYPWOIMBQUMY-KGLIPLIRSA-N 252.402 3.254 70 20 CGID CC[C@@H](N[C@@H](C)C(=O)NCC(C)C)c1ccc(F)cc1F 161014676 CIDJTGXCMYSNEN-XHDPSFHLSA-N 298.377 3.166 70 20 CGID CN(C(=O)[C@@H]1CCC[C@@H]1N)c1ccc(-c2ccccc2)cc1 161081560 GROTUHCGJAOAPU-MSOLQXFVSA-N 294.398 3.444 70 20 CGID CC[C@H](C)N(C)CCNC(=O)c1ccc(Cl)cc1C 161390083 JYLPKXLCFAOKKN-LBPRGKRZSA-N 282.815 3.109 70 20 CGID Cc1ccc(C(N)=O)cc1NCc1ccc([C@H]2C[C@H]2C)o1 160025662 SKVNMWUWOGQDLS-RISCZKNCSA-N 284.359 3.422 70 20 CGID CCCCO[C@H](C)C(=O)N[C@H]1CCOC2(CCCCC2)C1 160331617 AOKQTGMVPDEYIF-CABCVRRESA-N 297.439 3.190 70 20 CGID CCC(=O)c1cccc(NC(=O)CCc2ccncc2)c1 160755335 YYVBQRZXEFMADT-UHFFFAOYSA-N 282.343 3.246 70 20 CGID CC1(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)CCC1 160961256 CZNWRLROORELAV-QWHCGFSZSA-N 278.783 3.438 70 20 CGID O=C(NCCOc1ccccc1Cl)[C@H]1CC=CCC1 159400673 PGXIZRIDKTXUSH-LBPRGKRZSA-N 279.767 3.191 70 20 CGID C1=C(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)COc2ccccc21 159558467 BEZYUXJZLKTFCM-JQHSSLGASA-N 297.398 3.010 70 20 CGID Cc1nccc(NC(=O)N2[C@@H](C)CC[C@H]2C)c1Cl 159758044 WHPMWEKRAYZPAN-DTORHVGOSA-N 267.760 3.448 70 20 CGID Cc1ccccc1[C@H](C)SCCN1CCOCC1 159772266 QNKDWOZKUJQEJX-AWEZNQCLSA-N 265.422 3.121 70 20 CGID CN(C)C1(CNc2nc3ccc(N)cc3s2)CCCC1 160712586 MVFRCHCGQDJUEO-UHFFFAOYSA-N 290.436 3.165 70 20 CGID C[C@H]1CCC[C@H](C(=O)NC2CCN(C(C)(C)C)CC2)C1 161200972 UCYQJILLRKJGOT-KBPBESRZSA-N 280.456 3.192 70 20 CGID COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CC=CCC2)o1 161215280 SGKAGNAFKXKFPC-HIFRSBDPSA-N 289.375 3.446 70 20 CGID CCC[C@H](N[C@@H](CCO)CSC)c1ccc(OC)cc1 160185046 UWYSVYIDRQKBMT-HOCLYGCPSA-N 297.464 3.240 70 20 CGID CCC1(CNC(=O)NC[C@H](C)SC)CCCC1 160400155 ZRFGVMYZYRXCHQ-NSHDSACASA-N 258.431 3.008 70 20 CGID CCc1nc(CN[C@H](c2ccccc2C)C(C)C)n[nH]1 160425555 ZFQGOORHHDXSEY-INIZCTEOSA-N 272.396 3.162 70 20 CGID CC[C@@H](NCC(C)(C)O)c1cc(Cl)ccc1OC 160598627 SEFWVFFLPZWYGP-GFCCVEGCSA-N 271.788 3.160 70 20 CGID Cc1cc(C)cc(NC(=O)NCC(C)(C)[C@@H](O)C(C)C)c1 160832165 SIHDSCDTOSJSHK-HNNXBMFYSA-N 292.423 3.468 70 20 CGID O=C(CCc1cscn1)N[C@H]1CCCc2sccc21 159810706 YKJADMXTELSYPW-LBPRGKRZSA-N 292.429 3.331 70 20 CGID C[C@H](CC(=O)N(C)C)c1ccccc1C(F)(F)F 159817467 HSSGVJNQPZRLRT-SECBINFHSA-N 259.271 3.287 70 20 CGID CC[C@H](C)N(C)C(=O)Nc1ccnc(C)c1Cl 159450505 CZVFMBJBFFAKFD-QMMMGPOBSA-N 255.749 3.306 70 20 CGID COc1ccc(CN(C)Cc2ccc(NC(C)=O)cc2)cc1 159858370 DKZYCOOHRDLWNM-UHFFFAOYSA-N 298.386 3.286 70 20 CGID CCCOCC(=O)N1C[C@H](C)CSc2ccccc21 159675470 MLBQYVLFSAYVTC-LBPRGKRZSA-N 279.405 3.188 70 20 CGID CC(C)CCn1ccc(N[C@@H](C)c2ccncc2)n1 159871925 OWONQLAOHFDRBD-ZDUSSCGKSA-N 258.369 3.497 70 20 CGID CCC[C@H](C(=O)N[C@@H](CCO)c1ccccc1)C(C)C 159516399 XRNSKETUQJAEQZ-HOTGVXAUSA-N 277.408 3.299 70 20 CGID CCC(C)(C)C(=O)N[C@@H]1CCOC2(CCCC2)C1 159729701 MYRBMOLWWFNXTH-GFCCVEGCSA-N 253.386 3.031 70 20 CGID COC[C@@H](NC(=O)Nc1cc(F)ccc1Cl)C1CC1 159978014 JCCFKNKBEBABLL-GFCCVEGCSA-N 286.734 3.026 70 20 CGID Cc1ccc2cc(C(=O)N(C)C[C@@H]3CCCCO3)ccc2n1 159586895 QJKCUGRPKLBTSE-INIZCTEOSA-N 298.386 3.184 70 20 CGID CC[C@@H](C(=O)N(C)CC(F)F)c1ccc(F)cc1 159784433 MLYVGQFTDAKPQO-LLVKDONJSA-N 259.271 3.043 70 20 CGID C[C@@H](C1CC1)N(Cc1ccccc1)Cc1ccnn1C 159681078 BZJJJVFNBAPWNY-AWEZNQCLSA-N 269.392 3.221 70 20 CGID CC[C@@H](C)[C@@H](C(=O)N(CC)CCCO)c1ccccc1 160485497 JNTNXQLSTDPCBT-GDBMZVCRSA-N 277.408 3.047 70 20 CGID Cc1cc(C)c(C)c(OC(=O)c2ccc(C)n2C)c1 216789882 FGROLOLBSOHKSG-UHFFFAOYSA-N 257.333 3.478 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1oc(C)nc1C 161322622 VZBNSVKTWBOXEE-OLZOCXBDSA-N 264.369 3.332 70 20 CGID CC[C@@H](NC1CCN(C)CC1)c1cc(Cl)ccc1OC 161437760 BJTYSHNLFQQBMB-OAHLLOKOSA-N 296.842 3.484 70 20 CGID CC/C=C(/C)C(=O)NC[C@H]1[C@H]2c3ccccc3C[C@H]21 161456320 DSQTWDVLNHMXCO-YOUAKEQLSA-N 255.361 3.045 70 20 CGID CC[C@H](NC(=O)c1cccc(C)c1)c1c(C)noc1C 160052706 QZPJJYOGCWZBIF-AWEZNQCLSA-N 272.348 3.481 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cccnc1Cl 160084487 OOJJWFFSVGMKGE-RYUDHWBXSA-N 269.820 3.116 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1cc(C)oc1C 160153515 LGYFTSUOPOYWHP-HNNXBMFYSA-N 285.343 3.322 70 20 CGID COc1csc(C(=O)Nc2cccc(OCCF)c2)c1 160398652 VEZICXCRWNDKPO-UHFFFAOYSA-N 295.335 3.357 70 20 CGID C[C@@H](Cc1cccs1)NC(=O)N1CCC2(CCC2)C1 160412966 FWQIDECFSYGKFB-LBPRGKRZSA-N 278.421 3.265 70 20 CGID CCC(C)(C)NC(=O)Cc1cccc(OC(F)(F)F)c1 160572334 AVAJQPVBWFRIRQ-UHFFFAOYSA-N 289.297 3.433 70 20 CGID Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cccnc2O)c1 160682801 DFMWTTRNHDFGAF-MRXNPFEDSA-N 296.370 3.381 70 20 CGID CC[C@H](NC(=O)CC[C@H]1CCCCO1)c1c(C)noc1C 160712533 XKRSOJYKSQFDCA-KGLIPLIRSA-N 294.395 3.208 70 20 CGID CC[C@@H](N[C@@H](CN1CCCC1=O)c1ccccc1)C1CC1 160772345 ZPBDHNKZSDDLTN-SJORKVTESA-N 286.419 3.128 70 20 CGID CCc1cccc(NC(=O)N[C@H]2CCOC(C)(C)C2)c1 160914395 UARZSZQFWDODPX-AWEZNQCLSA-N 276.380 3.328 70 20 CGID CC(C)(CNC(=O)Nc1cccnc1)C1CCCC1 160955332 IBFUUJIEKXMFFF-UHFFFAOYSA-N 261.369 3.420 70 20 CGID Cc1cn2c(CN(C)C(=O)c3ccccc3)c(C)nc2s1 160997395 QCPDLWCHJGYTSA-UHFFFAOYSA-N 299.399 3.285 70 20 CGID COc1ccccc1[C@H](C)CC(=O)NCC1(C2CC2)CC1 159885250 URXYBHHFLKFXFU-CYBMUJFWSA-N 287.403 3.495 70 20 CGID CCCC1(CNC(=O)NC2C[C@@H](C)O[C@H](C)C2)CCC1 159956695 IOUQVXMXRIAKIE-CHWSQXEVSA-N 282.428 3.212 70 20 CGID CC[C@@H](Nc1ccc(OC2CCCC2)cc1)C(=O)OC 159506286 NIQXCRHELYUQOB-OAHLLOKOSA-N 277.364 3.372 70 20 CGID Cc1c(CN[C@@H](C)c2ccc(F)c(Cl)c2)cnn1C 160870644 FAHXRGCKQWWKIL-VIFPVBQESA-N 281.762 3.372 70 20 CGID CC1(C)[C@@H]2C[C@@H]1CC=C2COC(=O)[C@@H]1CSCCS1 218543825 LUIHIISHLVYQCV-XQQFMLRXSA-N 298.473 3.371 70 20 CGID Cc1cc2c(c(C)c1Cl)C=C(S(=O)(=O)Cl)CO2 100645386 KXFQZPAZSIZMSV-UHFFFAOYSA-N 293.171 3.259 70 20 CGID O=C(N[C@H]1CCOC2(CCCC2)C1)c1ccc(F)c(F)c1 161371625 UJZXWDKPXOFLQY-LBPRGKRZSA-N 295.329 3.186 70 20 CGID CC[C@@H](C)N(C)CCNC(=O)c1ccc(Cl)cc1C 161389954 JYLPKXLCFAOKKN-GFCCVEGCSA-N 282.815 3.109 70 20 CGID Cc1ccc(C(=O)Nc2[nH]nc(-c3ccc(C)o3)c2C)o1 161499124 LMMWAAVXKKVRIW-UHFFFAOYSA-N 285.303 3.440 70 20 CGID CS[C@@H](C)CC(=O)N1CCCc2ccc(F)cc21 160153420 ODDJBECZKAWNGO-JTQLQIEISA-N 267.369 3.247 70 20 CGID CC[C@H](NC(=O)CCC1CC1)c1c(C)noc1C 160512356 GMLFUEUCRVYEAP-LBPRGKRZSA-N 250.342 3.049 70 20 CGID CCN(CCNC(=O)c1ccc(F)c(SC)c1)C(C)C 160811825 JVAQYZSMINUHCQ-UHFFFAOYSA-N 298.427 3.008 70 20 CGID CN(Cc1cccn1C)C(=O)CCCC(C)(C)C 160897692 TXYHTJMFJXGTFS-UHFFFAOYSA-N 250.386 3.200 70 20 CGID Cc1cccc(N(C)C(=O)Cc2ccc(F)cc2Cl)n1 160975293 BFHDKWPUZCEKFC-UHFFFAOYSA-N 292.741 3.388 70 20 CGID c1cnc2ccc(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2c1 159478024 YAPOJXIEQDOQEW-JQHSSLGASA-N 294.398 3.282 70 20 CGID Cc1nc(CC(=O)N2C[C@H](C)CCC[C@H]2C)c(C)s1 159490193 QKMUFGRUWJECAQ-GHMZBOCLSA-N 280.437 3.340 70 20 CGID CC(C)Oc1cccc(CSCCN2CCOCC2)c1 159895959 KCETVJBIXYABBY-UHFFFAOYSA-N 295.448 3.039 70 20 CGID C[C@H]1CCC[C@H](C(=O)NCc2cccc(CN(C)C)c2)C1 159716980 FICARLJCDKSFRB-YOEHRIQHSA-N 288.435 3.191 70 20 CGID CCn1cc([C@@H](C)NC[C@@H](C)N2CCc3ccccc32)cn1 159924438 PYRBMQQHZQPAJL-HUUCEWRRSA-N 298.434 3.005 70 20 CGID C[C@H]1CCCC[C@H]1NC(=O)NCCCOc1ccccc1 217299734 VITMWBWYWCWVNH-GOEBONIOSA-N 290.407 3.333 70 20 CGID COc1ccc(C(=O)N[C@@H](C)CCc2ccco2)c(F)c1 218440639 GRHMFPWLECBPDV-NSHDSACASA-N 291.322 3.178 70 20 CGID C[C@H]1CCC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)C1 218630510 PEZRJATXXMRQAX-JQWIXIFHSA-N 287.812 3.197 70 20 CGID CC[C@H](C)[C@@H](C)NC[C@@H](O)COc1ccc(C)cc1C 218781570 XLJLTAHJHJBFRE-NUEKZKHPSA-N 279.424 3.067 70 20 CGID C[C@@H]1CCCC[C@H]1NC(=O)COc1ccc2[nH]ccc2c1 160019172 IPORJJHCZCHQHU-IUODEOHRSA-N 286.375 3.242 70 20 CGID CCO[C@H](C)C(=O)O[C@@H](C)c1cc(C)ccc1OC 160213364 XIDQHOMRTCHSLV-NWDGAFQWSA-N 266.337 3.033 70 20 CGID CCc1ccc(CC(=O)N2CCC[C@H]2c2ccc[nH]2)cc1 160303394 UOBINEICEZKWQL-KRWDZBQOSA-N 282.387 3.483 70 20 CGID COC[C@H]1CCCN(C(=O)C2CCC(C)(C)CC2)C1 160356113 BUAKFAADLMIXFJ-ZDUSSCGKSA-N 267.413 3.088 70 20 CGID C[C@H](CO)N(C)C(=O)CC(c1ccccc1)c1ccccc1 160506933 KCRRGUGORGEILG-OAHLLOKOSA-N 297.398 3.048 70 20 CGID Cc1nc2n(n1)C[C@H](N[C@H](C)c1cc(C)c(C)cc1C)CC2 160555621 FCJZLQSKWLULOW-GDBMZVCRSA-N 298.434 3.177 70 20 CGID CC(=O)O[C@@H](C)c1ccc(F)c(C(F)(F)F)c1 159449200 IJGGFCKDXGFLSE-LURJTMIESA-N 250.191 3.469 70 20 CGID COc1ncccc1NC(=O)[C@H](c1ccccc1)C1CC1 159672653 BBVCACAIGDPXBG-OAHLLOKOSA-N 282.343 3.223 70 20 CGID C[C@@H](CC(=O)NCC1(N)CCCCC1)c1ccccc1F 159765562 WIBBLDUSXQMRSU-ZDUSSCGKSA-N 292.398 3.097 70 20 CGID Cc1ccccc1CCNC(=O)c1cccc(C)c1F 161409809 QRQKDQWQSDGIGS-UHFFFAOYSA-N 271.335 3.415 70 20 CGID O=C(c1ccc(F)c(Cl)c1)N(CC(F)F)C1CC1 160099222 NLZPIRFUKIYCSP-UHFFFAOYSA-N 277.673 3.349 70 20 CGID CC(C)(C)OC(=O)CSCc1cnc(Cl)s1 160984997 XTTKIYSPKZBWLO-UHFFFAOYSA-N 279.814 3.371 70 20 CGID COCCC1(C(=O)Nc2cc(F)cc(F)c2)CCC1 160236063 COJODFOWHFTAQR-UHFFFAOYSA-N 269.291 3.110 70 20 CGID C[C@@H]1CCCN(C[C@@H](O)c2cc3ccccc3o2)C1 216879657 BQXRUMHZFNYRQK-TZMCWYRMSA-N 259.349 3.198 70 20 CGID C[C@H]1CCCN(Cc2csc(NC(=O)C3(C)CC3)n2)C1 161363614 WMMAJQXZNHDONL-NSHDSACASA-N 293.436 3.114 70 20 CGID Cc1cccn2cc(CN[C@H](C)CCc3ccco3)nc12 161461718 YVTBPJAKLZQQIC-CQSZACIVSA-N 283.375 3.347 70 20 CGID CCOc1cc(Cl)ccc1NC(=O)[C@@H]1CCC[C@H](N)C1 161501765 XMNHZNFAAQDCTG-PWSUYJOCSA-N 296.798 3.195 70 20 CGID COc1cccc([C@H](C)CC(=O)NCC2(C3CC3)CC2)c1 160102733 GOIPQKFHWHOGFM-CYBMUJFWSA-N 287.403 3.495 70 20 CGID CS[C@@H](C)CC(=O)Nc1ccc(Cn2cccn2)cc1 160181778 QSJLEEUZVAUCBT-LBPRGKRZSA-N 289.404 3.012 70 20 CGID CCC[C@H](CCc1ccccc1)NC(=O)CC1(N)CCC1 160939250 RWGALODEEMSDLN-MRXNPFEDSA-N 288.435 3.176 70 20 CGID Cc1ccc(C(=O)N(C)CC(F)F)c(Br)c1 159931683 HBWHMTBGHTVNOE-UHFFFAOYSA-N 292.123 3.095 70 20 CGID COc1cccc([C@H](O)CN[C@H](C)c2cccs2)c1 160723705 QXCGMAMTNKRDII-BXUZGUMPSA-N 277.389 3.141 70 20 CGID CC[C@H](NCc1cccc(OC)n1)c1ccc(F)cc1 160847903 BBHDIYNUYBFODU-HNNXBMFYSA-N 274.339 3.470 70 20 CGID CCN(CCN[C@@H](C)c1cncs1)C(=O)OC(C)(C)C 159457810 AIKKRARVGJRXTK-NSHDSACASA-N 299.440 3.051 70 20 CGID O=C(NCC1(C2CC2)CC1)c1ccc(F)cc1Cl 160152364 ZWQFJUYMABXMCO-UHFFFAOYSA-N 267.731 3.399 70 20 CGID Cc1cnc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)nc1C 160231064 NUJNPPSSSDNWSE-YOEHRIQHSA-N 296.418 3.026 70 20 CGID O=S(=O)(Cl)c1cc(F)cc(-c2ccccc2)c1 104832279 PMIZUYPLMCXUSC-UHFFFAOYSA-N 270.712 3.420 70 20 CGID COc1ccc(C(=O)NC[C@@H]2CCC[C@H](C)C2)c(F)c1 218013108 IVVYEKHNZMJJPU-NWDGAFQWSA-N 279.355 3.390 70 20 CGID CC[C@@H](N[C@H](C)c1nnc(C)o1)c1ccc(F)cc1F 161002455 OARDBOKMIDSOEQ-AMIZOPFISA-N 281.306 3.458 70 20 CGID CC(C)c1ccc(C(=O)N(Cc2ccncc2)C2CC2)cn1 161178190 VSPRXIXZOBXUME-UHFFFAOYSA-N 295.386 3.405 70 20 CGID CO[C@]1(C)C[C@H](N(C)C(=O)Nc2ccc(C)nc2)C1(C)C 161324181 VBKWTVUYWHGNIH-XJKSGUPXSA-N 291.395 3.057 70 20 CGID CCOc1cccc(NC(=O)N[C@@H](C)C2CCC2)c1 161417347 SEJGNHMPZYRTIM-NSHDSACASA-N 262.353 3.395 70 20 CGID Cc1c(/C=C/C(=O)N(C)[C@@H](C)c2cccs2)cnn1C 160018867 VSTASQGNBQVKML-GUOLPTJISA-N 289.404 3.023 70 20 CGID NC1(c2noc(C3C4CC5CC(C4)CC3C5)n2)CCCC1 160250951 RIXIXFUFQDTLRP-UHFFFAOYSA-N 287.407 3.337 70 20 CGID C[C@@H](NC(=O)CC1CCNCC1)c1ccc(F)cc1Cl 159628373 FFKLJZMBOAAEIH-SNVBAGLBSA-N 298.789 3.046 70 20 CGID Cc1ccc(CNC(=O)NC[C@]2(C)CCCS2)s1 159970783 XHSGETXVODSOPR-ZDUSSCGKSA-N 284.450 3.141 70 20 CGID Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(C)c1 159599553 OFYXEPHJKVUSSV-BBWFWOEESA-N 271.404 3.351 70 20 CGID CC(C)(C)C[C@@H](CO)Nc1nc(C(F)(F)F)cs1 161439722 AHKYEJKMVULVKE-ZETCQYMHSA-N 282.331 3.371 70 20 CGID CCCOc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)cc1 217632607 ILXQLUVIZJKCJZ-MSOLQXFVSA-N 288.435 3.192 70 20 CGID Cc1cc(C(=O)CN2CCC[C@@H]3CCCC[C@H]32)c(C)[nH]1 217811165 YTHAMVGEDWGTAY-GOEBONIOSA-N 274.408 3.469 70 20 CGID Cc1ccccc1[C@@H]1C[C@H]1C(=O)N(C)Cc1cccn1C 161005388 PXRZJAAIFXFLBD-DLBZAZTESA-N 282.387 3.096 70 20 CGID CCNCC1CCN(C(=O)[C@H]2C[C@@H]2C2CCCCC2)CC1 161008810 LPFLHDUTRMZDLR-SJORKVTESA-N 292.467 3.051 70 20 CGID C[C@H]1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)C[C@@H]1C 161331064 KHANVLGMHHHDBR-GJZGRUSLSA-N 294.483 3.249 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc(F)c(F)c1 161371510 UJZXWDKPXOFLQY-GFCCVEGCSA-N 295.329 3.186 70 20 CGID CCO[C@@H](C)c1nccn1CCN(C)c1ccccc1 161493469 MODRSFQFCUAKRK-AWEZNQCLSA-N 273.380 3.117 70 20 CGID CC(C)CONC(=O)Nc1ccc(F)cc1OC(F)F 160592460 ZKPIKOZLNKPNLD-UHFFFAOYSA-N 292.257 3.136 70 20 CGID Cc1ccc(CCCCC(=O)N[C@@H](CCO)C(C)C)cc1 160717408 MQFNRTHZNMJJOT-KRWDZBQOSA-N 291.435 3.231 70 20 CGID CC[C@H](C)[C@H](C(=O)N[C@@H](CCO)C(C)C)c1ccccc1 160772948 RTHNXJKPEGGATK-XIRDDKMYSA-N 291.435 3.340 70 20 CGID Cc1nc2ccccc2cc1C(=O)N(C)Cc1cccn1C 160957201 OAHZMWSNTPLHHM-UHFFFAOYSA-N 293.370 3.154 70 20 CGID CCCCn1ncc(NC(=O)N[C@H]2CCC[C@H]2C)c1C 159801356 SFHVANRKEOXCMM-YPMHNXCESA-N 278.400 3.302 70 20 CGID CCC(CC)(CC)CNC(=O)N(C)C[C@H]1CCCCO1 159547684 GZZSFPXORFLZLF-CQSZACIVSA-N 284.444 3.413 70 20 CGID Cc1cccc([C@H](C)NCc2cc(C(N)=O)cs2)c1 160202323 KAPSTUAYAPQFCS-NSHDSACASA-N 274.389 3.006 70 20 CGID NC(=O)c1ccc(F)c(NCc2ccc(Cl)cc2F)c1 160717187 AZXZYFYWDZZZIW-UHFFFAOYSA-N 296.704 3.329 70 20 CGID CC(C)(C)[C@H]1CCN(C(=O)Nc2ccc(CN)cc2)C1 160979496 FQYCZVHVMQDYJU-ZDUSSCGKSA-N 275.396 3.045 70 20 CGID CCc1cnc(CN(C)CCCN2CCCCC2)s1 161385465 BKJDAWCZIGUXSI-UHFFFAOYSA-N 281.469 3.013 70 20 CGID CC(C)C[C@H]1CCN(CCCN2CCCCC2)C1 161348215 NOGBAABWYMGNAD-MRXNPFEDSA-N 252.446 3.230 70 20 CGID Cc1ccccc1C(=O)Cn1c(C)nc2c1CCCC2 216900524 YDFSOBHPBPFLGZ-UHFFFAOYSA-N 268.360 3.262 70 20 CGID CC(=O)Nc1cc(NC(=O)N[C@H](C)C2CCC2)ccc1C 161090105 BGWZEBPTFLVOPR-LLVKDONJSA-N 289.379 3.264 70 20 CGID CC[C@@H](NC(=O)c1cccc(F)c1F)c1c(C)noc1C 160192930 YWYYQOXXBVWOHK-GFCCVEGCSA-N 294.301 3.451 70 20 CGID CC(C)OC(=O)CCCNc1nc2ccccc2s1 160249302 QLIFVABZDXBXMY-UHFFFAOYSA-N 278.377 3.440 70 20 CGID C[C@H]1C[C@@H](N(C)C(=O)C2CCC(C)(C)CC2)CCN1C 160658636 MUSNNEZPNJRIOZ-ZFWWWQNUSA-N 280.456 3.144 70 20 CGID Cc1conc1NC(=O)[C@@H](C)Cc1cccc(Cl)c1 160781081 GCABHNKCOASOOH-VIFPVBQESA-N 278.739 3.454 70 20 CGID CCOc1cccc(CN(C)Cc2ccc(OC)cc2)n1 159861302 FHWSBNBLPDRGKT-UHFFFAOYSA-N 286.375 3.121 70 20 CGID OCC1(CNCc2cccc(C(F)(F)F)c2)CCCC1 160108378 YKFHQZNARKQNHK-UHFFFAOYSA-N 287.325 3.348 70 20 CGID CCC[C@@H](C(=O)N[C@H](C)c1cc2ccccc2o1)N(C)C 161279550 LFKKIQLLMQCBNK-OCCSQVGLSA-N 288.391 3.340 70 20 CGID CC[C@@H](S[C@@H]1CCN(C)C1=O)c1ccc(F)cc1F 161374603 PGZRYKZFQOGJSZ-CHWSQXEVSA-N 285.359 3.380 70 20 CGID Cc1ccc(NC(=O)NCc2cccc(Cl)c2)cn1 161412163 HAZGMOODTIMPBP-UHFFFAOYSA-N 275.739 3.365 70 20 CGID CCCCS(=O)(=O)c1ncc(C(C)(C)C)s1 160376556 RYVHARFVSPOHKL-UHFFFAOYSA-N 261.412 3.014 70 20 CGID COC[C@H](NCC1(Sc2ccccc2)CC1)C1CC1 160510105 UQAUZAZMCKYLPA-HNNXBMFYSA-N 277.433 3.326 70 20 CGID Cc1ccc(SCCN[C@@H]2CCN(C)C[C@@H]2C)cc1 160793832 LOBPMGLTZJHDQF-GOEBONIOSA-N 278.465 3.017 70 20 CGID CCN(CC)C[C@@H]1CCN(C(=O)C2CCC(C)(C)CC2)C1 160811060 YDFSEGBCYOMVJE-HNNXBMFYSA-N 294.483 3.393 70 20 CGID Cc1cc(C)cc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c1 160830431 VIWQVVPKGVQZSA-CYBMUJFWSA-N 276.380 3.383 70 20 CGID COc1ccc(CN(C)Cc2cccnc2C)c(OC)c1 160838459 VXWZYPWEROVOBW-UHFFFAOYSA-N 286.375 3.039 70 20 CGID O=C([C@H]1CC=CCC1)N1CCc2c(F)cccc2C1 160844544 AGYUMGFBCKERSL-LBPRGKRZSA-N 259.324 3.067 70 20 CGID CS[C@H](C)CNC(=O)c1cccc(C(F)(F)F)c1F 159402879 RGTNBPDDQRNTFA-SSDOTTSWSA-N 295.301 3.326 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)N(C)c1ccc(OC)c(F)c1 159669216 SFZZIUUVAJEFLF-XHDPSFHLSA-N 265.328 3.233 70 20 CGID Cc1ccccc1C(C)(C)CNC(=O)c1ccnn1C(C)C 159890674 GPBPMUGGFFEDQI-UHFFFAOYSA-N 299.418 3.480 70 20 CGID COCC(C)(C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 159714090 FWTDLNVEQZFWFX-ZDUSSCGKSA-N 289.419 3.415 70 20 CGID CCCCn1ncc(NC(=O)N(C)[C@@H](C)C2CC2)c1C 159742289 STXPMYNWMOVBIN-NSHDSACASA-N 278.400 3.254 70 20 CGID CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)NC(C)(C)C)C1 217313513 YFWLJYMGRKEAKA-XHDPSFHLSA-N 252.402 3.395 70 20 CGID COc1cccc(COC(=O)c2cc(F)cnc2Cl)c1 218160072 QCWVWKINFWAXEE-UHFFFAOYSA-N 295.697 3.240 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1nc(C)ncc1Cl 161077040 KGTSALAFUASCTM-WCQYABFASA-N 295.814 3.479 70 20 CGID COc1ccc(NC(=O)N[C@H](C)C2CCC2)cc1F 161129646 NPWFOQGRPHRYNF-SECBINFHSA-N 266.316 3.144 70 20 CGID COc1ccc(CC[C@@H](C)NC(=O)C[C@@H](C)SC)cc1 161389740 ZXFXFRMOVZKJTM-CHWSQXEVSA-N 295.448 3.274 70 20 CGID Cc1cc([C@H]2CCCN2C(=O)c2cccc(C)c2F)on1 161466567 ONHJDCNSVXGAFJ-CYBMUJFWSA-N 288.322 3.408 70 20 CGID O=C(CCCc1nc2ccccc2[nH]1)NCC1(C2CC2)CC1 160040895 SSXRMQDJHGUDLY-UHFFFAOYSA-N 297.402 3.192 70 20 CGID O=C(CCc1ccccn1)N[C@H]1CCCc2sccc21 160056019 TYPFFPCZCCEPOM-AWEZNQCLSA-N 286.400 3.270 70 20 CGID CC1(NC(=O)N[C@@H]2CCCOc3ccccc32)CCC1 160392425 FGTBUXWZHBPZFN-CYBMUJFWSA-N 274.364 3.142 70 20 CGID CCO[C@H]1C[C@H](NCC2(N(C)C)CCCC2)C12CCCC2 160675793 HQVGSEHWRQUIER-HOTGVXAUSA-N 294.483 3.188 70 20 CGID CC[C@@H](NC(=O)CC1(N)CCC1)C(C)(C)c1ccccc1 160763435 NATPMQXODOGDSN-OAHLLOKOSA-N 288.435 3.131 70 20 CGID CCCCOc1cccc(CN[C@@H]2CCN(C)[C@H](C)C2)c1 160815317 WAXIVDROTWTWQK-NVXWUHKLSA-N 290.451 3.438 70 20 CGID COC(=O)CN(C1CC1)[C@H](C)c1ccc(Cl)cc1 159487153 RTRJDKZVXXXTOC-SNVBAGLBSA-N 267.756 3.038 70 20 CGID CC[C@H]1CCCC[C@H]1NCc1ccc(N(C)C)nc1 159852393 IDJSBQKXACYLBQ-LSDHHAIUSA-N 261.413 3.206 70 20 CGID COc1ncccc1CNCc1ccc(Cl)cc1F 160766441 QOKNNQMNFBGILY-UHFFFAOYSA-N 280.730 3.173 70 20 CGID CCn1cnnc1CNCc1ccc(-c2ccccc2)s1 218222321 KFIVOFHTIPEQPS-UHFFFAOYSA-N 298.415 3.316 70 20 CGID CC(C)(C)C[C@@H](O)CNCc1cccc2c1OC(C)(C)C2 217811131 IOPSQBFPRJIRGA-OAHLLOKOSA-N 291.435 3.287 70 20 CGID O=C(NCCCCc1ccccc1)Nc1ccccn1 217311337 YCJYZYUIHZSYMA-UHFFFAOYSA-N 269.348 3.226 70 20 CGID C[C@H]1CCC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 864237811 MZQKWZXASZHQSV-QWRGUYRKSA-N 299.367 3.110 70 20 CGID CCc1ccccc1NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1 161109486 UULRWTROGHLHBR-ZBFHGGJFSA-N 288.391 3.328 70 20 CGID CCOc1cccc(NC(=O)N[C@H](CC)[C@@H]2CCCO2)c1 161416991 MCQRDZSSBIAIQS-CABCVRRESA-N 292.379 3.164 70 20 CGID CCN(CC)C(=O)C[C@H](C)N[C@@H](C)Cc1ccccc1C 160772087 LAPZIIWLZBZDOU-HOTGVXAUSA-N 290.451 3.163 70 20 CGID COc1ccccc1[C@H](C)CC(=O)Nc1cccc(F)n1 160776163 ACBDQMYGTQDHDM-LLVKDONJSA-N 288.322 3.362 70 20 CGID CCCOc1cccc(CC(=O)Nc2ccccn2)c1 160836737 COQNRDXLSVOHPC-UHFFFAOYSA-N 270.332 3.052 70 20 CGID CCCCn1c(SCc2nnc(C)n2C)nc(C)c1C 160984837 MWVPRWAPFHEPOY-UHFFFAOYSA-N 293.440 3.029 70 20 CGID CCOCCC1(CNC(=O)N[C@@H]2CCCC2(C)C)CC1 159461067 OFNTVQULSFDVAC-CYBMUJFWSA-N 282.428 3.071 70 20 CGID CC(C)[C@@H](C)CC(=O)N(C)CCOCc1ccccc1 159500918 YVGSOJADBRNZMW-HNNXBMFYSA-N 277.408 3.344 70 20 CGID C[C@@H](C(=O)NCC1(C2CC2)CC1)c1cccc(F)c1 159721252 XDTACEBRQXOSKM-LLVKDONJSA-N 261.340 3.236 70 20 CGID CC(C)[C@@H](CCO)NC(=O)c1cc2c(s1)CC[C@H](C)C2 160747062 OMRCYZMQRVEKRW-WCQYABFASA-N 295.448 3.010 70 20 CGID CCCc1nc(CSCCc2c(C)noc2C)no1 160134711 IMGWMJMGXGYTBL-UHFFFAOYSA-N 281.381 3.103 70 20 CGID Cc1onc(-c2ccccn2)c1C(=O)N1CC[C@@H](C)C[C@H]1C 160588127 COWFBQYBNJKVTN-VXGBXAGGSA-N 299.374 3.306 70 20 CGID COc1cc(CCC(=O)N(C)C(C)C)ccc1Cl 160671033 KNSRVIZLZGFSHP-UHFFFAOYSA-N 269.772 3.148 70 20 CGID Cc1nc(COC(=O)[C@@H]2C[C@H]2c2ccco2)c(C)s1 160800601 FBUPFHGVDRJVRY-GHMZBOCLSA-N 277.345 3.200 70 20 CGID CCCCN1CCc2ccc(NC(=O)c3cc[nH]c3)cc21 160958173 VZFQGFVKCAAXCV-UHFFFAOYSA-N 283.375 3.430 70 20 CGID O=C(Nc1nc2ccc(Cl)cc2s1)[C@H]1CCCCO1 159654428 NFHFBBKKWJMLKG-SNVBAGLBSA-N 296.779 3.457 70 20 CGID CCC(C)(CC)C(=O)Nc1cccc(-n2cnnc2C)c1 159512160 PFUWHUKJYHWZKI-UHFFFAOYSA-N 286.379 3.341 70 20 CGID Fc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1F 159514240 JJMIWIWAGURYAO-CQDKDKBSSA-N 279.330 3.012 70 20 CGID C[C@@H]1Cc2ccc(F)cc2[C@H]1NCCOCC(F)(F)F 159377009 DXPCVFWZIMOAOI-RNCFNFMXSA-N 291.288 3.228 70 20 CGID COc1ccc2c(c1)C[C@@H](NCC1CCSCC1)CC2 159559524 NJWAZKFBBNJQIK-INIZCTEOSA-N 291.460 3.285 70 20 CGID CNc1ccccc1C(=O)Nc1ccc(F)c(OC)c1 160423232 RQJOKAZDBXGIIJ-UHFFFAOYSA-N 274.295 3.128 70 20 CGID Cc1ccc(/C=C/S(=O)(=O)N2[C@H]3C=CC[C@H]2CC3)cc1 218760911 QLMJTYAEACPPKQ-WFPWZJHXSA-N 289.400 3.088 70 20 CGID CN(C)[C@H]1CCC[C@@H](N[C@@H]2CCc3ccccc32)C1 161034885 BOXOVJHDLKZTBA-HLLBOEOZSA-N 258.409 3.136 70 20 CGID COCC(C)(C)c1nc(Cc2ccccc2Cl)no1 161475421 ISQORJZAGFIRHM-UHFFFAOYSA-N 280.755 3.238 70 20 CGID O=S(=O)(F)c1sc2ccccc2c1Cl 307234247 RMMHIASZSZHDAO-UHFFFAOYSA-N 250.703 3.213 70 20 CGID C[C@@H]1CCC[C@H](CNCc2nc3ccccc3n2C)C1 218133827 RYJVBHJIKYGBKJ-KGLIPLIRSA-N 271.408 3.489 70 20 CGID Cc1cc(NCCCOCC2CC2)nc(C(C)C)n1 218649565 QYYKJMPZPMSSQV-UHFFFAOYSA-N 263.385 3.137 70 20 CGID CC(C)C[C@@H]1CCCN(C(=O)c2cc(N(C)C)ccn2)C1 161028971 SXJBHHNDRWFZSJ-AWEZNQCLSA-N 289.423 3.046 70 20 CGID Cc1noc(C)c1[C@H](C)CC(=O)NCC1(C2CC2)CC1 161375864 SMFDKYRYEOKAML-SNVBAGLBSA-N 276.380 3.091 70 20 CGID Cc1ccc(NC(=O)N[C@@H](C)CNc2ccccc2)cn1 161417760 LDCWQFMQNVEGLI-ZDUSSCGKSA-N 284.363 3.012 70 20 CGID CCCc1cc(C(=O)N2CCc3c(Cl)cccc32)[nH]n1 161482446 QJFYCTNSDVOAMY-UHFFFAOYSA-N 289.766 3.219 70 20 CGID C[C@@H]1CN(C(=O)Nc2cccnc2Cl)CC[C@H]1C 160006979 GTZMWRQEDWUEMA-NXEZZACHSA-N 267.760 3.245 70 20 CGID O=C(CCc1ccccn1)N[C@@H]1CCCc2sccc21 160055877 TYPFFPCZCCEPOM-CQSZACIVSA-N 286.400 3.270 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NC(C1CC1)C1CC1 160433225 LXDYCAZHVZDWBN-OLZOCXBDSA-N 275.417 3.465 70 20 CGID C[C@H](N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccco1 160758318 AALOQMFCQJMTIZ-HOCLYGCPSA-N 298.386 3.294 70 20 CGID Cc1cccc([C@@H](C)NC(=O)[C@H](N)Cc2ccccc2)c1C 160834631 GUQUXLVFFVUZTM-CRAIPNDOSA-N 296.414 3.051 70 20 CGID CN(CCC1CC1)C(=O)Nc1ccc2c(c1)C(=O)CCC2 159809328 GPBMHINUDFFWOU-UHFFFAOYSA-N 286.375 3.469 70 20 CGID CCCCN1CCC(NC(=O)[C@@H](C)c2ccsc2)CC1 159629053 LCHUMCWPYMVVHE-ZDUSSCGKSA-N 294.464 3.232 70 20 CGID C[C@H](c1ncc(C(C)(C)C)o1)N(C)C[C@@H]1CCC[C@@H]1O 159637808 RLEFUELRIVHNNW-AGIUHOORSA-N 280.412 3.126 70 20 CGID COc1ccc(N(C)C(=O)c2ccc(C)cc2)cc1F 159392152 JMFHQLMSCHWAST-UHFFFAOYSA-N 273.307 3.419 70 20 CGID Clc1cccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1 159657088 WWHCFFNCVUZBQT-KFWWJZLASA-N 277.795 3.387 70 20 CGID CN(Cc1ccccc1C(F)(F)F)C[C@H]1CCC[C@@H]1O 159751743 YABIXSGNFMXBEU-OCCSQVGLSA-N 287.325 3.298 70 20 CGID CCOc1ccc(CNC(=O)N(C)Cc2ccccc2)cc1 217300840 WOVBSOFOQZAWJA-UHFFFAOYSA-N 298.386 3.427 70 20 CGID CC(=O)Nc1cccc(NC(=O)N2CCc3ccccc32)c1 217300663 ASDWFXZWAMLCFU-UHFFFAOYSA-N 295.342 3.240 70 20 CGID C[C@@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)c(F)c1 161131584 DBSLORBFQDQLEA-BNOWGMLFSA-N 282.378 3.488 70 20 CGID CCCn1nc(C)c(C(=O)N2CCc3ccccc32)c1C 161216963 IVHNKKFZNTZOFP-UHFFFAOYSA-N 283.375 3.113 70 20 CGID C[C@H]1CC[C@H](C)N1C(=O)C(C)(C)Oc1ccc(F)cc1 161467423 XMFYWQQNHRHZME-RYUDHWBXSA-N 279.355 3.383 70 20 CGID CN(C)CCN(C(=O)CCC(C)(C)C)C1CCCC1 160057697 PPXFJPFGLOEJIH-UHFFFAOYSA-N 268.445 3.146 70 20 CGID CC[C@@H](NC(=O)Nc1ccc(SC)cc1)[C@@H]1CCCO1 160117102 VWZKCDMMFLLDKS-KGLIPLIRSA-N 294.420 3.488 70 20 CGID CCc1nc(CN[C@@H](C)c2ccc3c(c2)CCCC3)n[nH]1 160277830 MEBYJQGIZDOFMC-LBPRGKRZSA-N 284.407 3.097 70 20 CGID CC(C)CC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160380672 KGBLDGQCIKWDFT-NSHDSACASA-N 261.243 3.274 70 20 CGID Cc1cnc(C[S@@](=O)c2ncc(C(C)(C)C)s2)o1 160548290 CSEQLGNQWWVNLF-SFHVURJKSA-N 284.406 3.045 70 20 CGID O=C(c1ccc(F)cc1)N1CC=C(C(F)(F)F)CC1 160572558 FLBNWABDWBGMKW-UHFFFAOYSA-N 273.229 3.160 70 20 CGID Cc1ccc2cccc(C(=O)N(C)Cc3cccn3C)c2n1 160575365 CAQAUWBNSMISBI-UHFFFAOYSA-N 293.370 3.154 70 20 CGID O=C(COc1ccccc1Cl)NCC1(C2CC2)CC1 159850572 CAMOTEZWWSQQQP-UHFFFAOYSA-N 279.767 3.025 70 20 CGID Cc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 159476851 RKYRNDDVDVYYLP-PMPSAXMXSA-N 257.377 3.042 70 20 CGID C[C@@H](Cc1cccc(Cl)c1)C(=O)NCCc1ccco1 159483566 UXIWFHPQIGPKIN-LBPRGKRZSA-N 291.778 3.471 70 20 CGID CC(C)n1cnnc1SCC(=O)CCC1CCCC1 159889036 XLLAFNZHNATOJO-UHFFFAOYSA-N 281.425 3.491 70 20 CGID Cc1ccoc1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159369715 IJWXMYMCBNBCKJ-HOCLYGCPSA-N 299.370 3.486 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2Nc1nc(C2CC2)ns1 159501951 FNTJKJDUSLIFAA-ZDUSSCGKSA-N 286.404 3.487 70 20 CGID CCn1nccc1CNCc1ccc(Cl)cc1Cl 159876496 VZRWBDJZLZQQFY-UHFFFAOYSA-N 284.190 3.500 70 20 CGID CC[C@@H](C)N(C)CCN[C@@H](C)c1ccc(OC)c(F)c1 160080503 IBFWJDOTCORTIG-OLZOCXBDSA-N 282.403 3.215 70 20 CGID CCOc1ccc(CNC(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 217300852 LSFULEIQHVWSSF-OKILXGFUSA-N 290.407 3.273 70 20 CGID CS[C@@H]1CC[C@H](Nc2ccc(C(F)(F)F)nn2)C1 218045337 LVFFQXGGAPDVAH-JGVFFNPUSA-N 277.315 3.191 70 20 CGID C[C@@H]1C[C@@H](C)CN(C[C@@H](O)c2cc3ccccc3o2)C1 216871191 YPEIIRPPCKKFLJ-UMVBOHGHSA-N 273.376 3.444 70 20 CGID Cc1nc2c(s1)[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)CCC2 161102943 JFIRFARKVNFTQW-VNHYZAJKSA-N 293.480 3.291 70 20 CGID CC[C@@H]1CCCC[C@H]1N(C)C(=O)CC[C@@H]1CCCO1 161121684 QGGXFGAWOBJMAD-QLFBSQMISA-N 267.413 3.373 70 20 CGID C[C@H](c1cc(F)ccc1F)N(C)C(=O)[C@@H]1CCCCO1 161165649 RGDTYCCEPRGFRB-YGRLFVJLSA-N 283.318 3.053 70 20 CGID CC(C)C[C@@H](CO)NC(=O)C[C@H](c1ccccc1)C(C)C 161202957 NRPPFQMHGSWWCM-IRXDYDNUSA-N 291.435 3.340 70 20 CGID CC[C@@H](C(=O)Nc1ccc(Oc2ccccc2)nc1)N(C)C 161333354 DMVMPWUSUMGRMA-HNNXBMFYSA-N 299.374 3.153 70 20 CGID Cc1cc(C)cc(CN2CCN(c3ccncc3)CC2)c1 161351854 IHWFLOUXODULDU-UHFFFAOYSA-N 281.403 3.021 70 20 CGID CC[C@H](S[C@H]1CCN(C)C1=O)c1ccc(F)cc1F 161374721 PGZRYKZFQOGJSZ-STQMWFEESA-N 285.359 3.380 70 20 CGID C[C@H]1CC[C@@H](C)N1C(=O)COc1ccc(F)c(Cl)c1 161460117 QSDIRKYPKYULBO-AOOOYVTPSA-N 285.746 3.257 70 20 CGID Cc1cc(C)c(C(=O)N(C)CCOc2ccccc2C)[nH]1 160109063 CENBKRGFKNQWLZ-UHFFFAOYSA-N 286.375 3.091 70 20 CGID CCCCNC(=O)c1ccc(CN[C@H](C)CC)cc1 160113959 ZHLPAMQSVIGOMR-CYBMUJFWSA-N 262.397 3.105 70 20 CGID FC(F)(F)c1cccc(N[C@@H]2CCO[C@@H](C3CC3)C2)n1 160297622 SZFKUITZZAKGJW-GHMZBOCLSA-N 286.297 3.470 70 20 CGID CCOC[C@H]1CCN(C(=O)C[C@@H]2CCCCC2(C)C)C1 160390616 SUCQXAOYNLYNTM-GJZGRUSLSA-N 281.440 3.478 70 20 CGID CCC[C@@H](N[C@@H]1CCc2nc(C)nn2C1)C1CCCCC1 160462752 WEHULPRFAGJZPS-HZPDHXFCSA-N 290.455 3.240 70 20 CGID CCc1nc(Cl)c(C)c(N[C@@H]2CCO[C@H](C3CC3)C2)n1 160469220 WOQUYEQEKJYTSA-NEPJUHHUSA-N 295.814 3.370 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@H](CC)c1c(C)noc1C 160755470 PCLJUVPPJFQADR-QWHCGFSZSA-N 282.384 3.064 70 20 CGID CCc1ccc([C@@H](CO)NC[C@H]2CC=CCC2)cc1 160766538 APCRQXJFFRCBDP-DOTOQJQBSA-N 259.393 3.228 70 20 CGID CC[C@H]1CCCC[C@H]1N(C)C(=O)CCCCCNC(C)=O 160868243 OFLHSTHJBIFCAA-JKSUJKDBSA-N 296.455 3.110 70 20 CGID CCn1cc([C@H](C)NC[C@@H]2CCc3ccccc32)cn1 160981914 ZWYVQYHCWZRUMX-ZFWWWQNUSA-N 269.392 3.284 70 20 CGID CC[C@@H](C(=O)NC[C@@H]1CCCS1)c1ccc(F)cc1 160989990 DBCWUSWUHZNPOL-UONOGXRCSA-N 281.396 3.331 70 20 CGID CC[C@@H](C)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 159474904 BMZXNAKLTIYDCP-YCPHGPKFSA-N 275.392 3.317 70 20 CGID CCCC[C@H](CC)CNC(=O)[C@@H]1CCC(=O)C[C@@H]1C 159670615 PIJFQLPDQWZBQR-KCQAQPDRSA-N 267.413 3.324 70 20 CGID CO[C@]1(CNc2ccc3ccccc3c2)CCOC1 160641850 VNALQVCWTPBZLD-INIZCTEOSA-N 257.333 3.057 70 20 CGID Cc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)CC2 161097922 JLOQWENBUOBATN-SOLBZPMBSA-N 272.436 3.445 70 20 CGID COc1ccc(C(=O)N[C@@H](c2ccccc2)C2CC2)c(O)c1 217566546 GUGXBEYDBMBLAB-KRWDZBQOSA-N 297.354 3.282 70 20 CGID C[C@H]1C[C@H](C)CN(Cc2csc(C3CC3)n2)C1 161262187 JBYWRRFYIKGKSB-QWRGUYRKSA-N 250.411 3.498 70 20 CGID CC(C)C[C@@H](CO)NC(=O)[C@@H](C)Cc1ccccc1Cl 161117586 QHGMHSMHCFKTGR-JSGCOSHPSA-N 297.826 3.042 70 20 CGID O[C@H](C1CCN(CCC2CCCC2)CC1)C(F)(F)F 161321589 PGOGXUBBFKUTHY-CYBMUJFWSA-N 279.346 3.202 70 20 CGID CC[C@@H](NC(=O)CC(C)(C)C)c1c(C)noc1C 160278702 LYYKYQQGWFGCHS-LLVKDONJSA-N 252.358 3.295 70 20 CGID COc1ccccc1CN(C(=O)C[C@H](C)SC)C1CC1 160428832 NVRJPLQBWPFVHP-LBPRGKRZSA-N 293.432 3.328 70 20 CGID C[C@H]1C[C@H](NCC2(Sc3ccccc3)CC2)CCN1C 160475882 OMWSFKPFOYIPRP-LSDHHAIUSA-N 290.476 3.384 70 20 CGID CC[C@H](NC(=O)Cc1cccc(F)c1)c1c(C)noc1C 160493525 WMSQIYVLGQZXJG-AWEZNQCLSA-N 290.338 3.241 70 20 CGID CC[C@@H](NC(=O)Nc1cc(C)ccc1F)[C@H]1CCCO1 159478293 QPZVCJXQKGTGCX-TZMCWYRMSA-N 280.343 3.213 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cc(F)cc(F)c1 159683660 RZZPWFUXXVPWNV-CQSZACIVSA-N 295.329 3.186 70 20 CGID C[C@@H](NC(=O)C(C)(C)F)c1cccc(N2CCCC2)c1 159496596 KYTZOJQUCWLOPE-GFCCVEGCSA-N 278.371 3.212 70 20 CGID CC[C@@H]1CN(c2nc(C(C)(C)C)ns2)CCS1 159759954 QUPUTINGCNBIRC-SECBINFHSA-N 271.455 3.167 70 20 CGID CC[C@H](O)[C@@H]1CCCCN1CCC(=O)c1ccc(C)cc1 159763316 BDEHNURFLMUXKD-IRXDYDNUSA-N 289.419 3.193 70 20 CGID CC(=O)N1CCC(NC2CC(C)(C)CC(C)(C)C2)CC1 159728420 ZWNIUHGKLKFDJN-UHFFFAOYSA-N 280.456 3.192 70 20 CGID CC[C@H](C)N(C)CCN[C@@H](C)c1cc(C)ccc1OC 160092702 YYMGHTFTTKIXJO-GJZGRUSLSA-N 278.440 3.385 70 20 CGID C[C@H](N[C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)c(F)c1 161131460 DBSLORBFQDQLEA-YUTCNCBUSA-N 282.378 3.488 70 20 CGID CC[C@@H]1CCCCN1C(=O)NCc1cccc(C)c1 217314500 PGKFMSGUZMCZCT-OAHLLOKOSA-N 260.381 3.469 70 20 CGID COc1ccc(NC(=O)[C@@H]2C[C@H]2C2CCCCC2)cc1N 161030312 MPGDBPUBBORLGY-UONOGXRCSA-N 288.391 3.432 70 20 CGID CCCCn1ncc(C(=O)N(C)[C@H](C)c2ccco2)c1C 161132651 MNSHYSNITKKWEU-CYBMUJFWSA-N 289.379 3.418 70 20 CGID CC(C)CC[C@@H](NC(=O)CCNC(C)C)C(C)(C)C 160072061 MKXNVULNGVCDJL-CQSZACIVSA-N 270.461 3.342 70 20 CGID CN(C(=O)CCSCCCF)c1ccccc1 160153115 LXDONOMRMAZAHC-UHFFFAOYSA-N 255.358 3.132 70 20 CGID COc1ccc(C)cc1[C@H](C)OC(=O)[C@H]1C[C@H]2CC[C@@H]1O2 160197003 BBXRYIZEZFNEPL-LMWOUKEDSA-N 290.359 3.175 70 20 CGID O=C(C[C@@H]1C=CCC1)N[C@H]1CCOC2(CCCCC2)C1 160402385 ITDKRSBVDUCOSG-CABCVRRESA-N 277.408 3.341 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)N(C)c1nc2ccccc2o1 160724606 IRCWKHVJFXHKBY-BMIGLBTASA-N 258.321 3.227 70 20 CGID C[C@@H]1CCN(C(=O)C[C@@H](C)c2ccncc2)[C@H](C)C1 160758763 YZPUCWKDTSUAGR-MGPQQGTHSA-N 260.381 3.222 70 20 CGID CC1(C)C[C@H](NC(=O)Nc2cc(F)ccc2F)CCO1 160793427 YSDOVKJDAVOTNT-SNVBAGLBSA-N 284.306 3.044 70 20 CGID CC(C)(C)c1nsc(NC[C@]2(C)CCCC[C@@H]2O)n1 159828787 XNATVMXFSZSYGI-HZMBPMFUSA-N 283.441 3.189 70 20 CGID CSc1ccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)o1 159631153 SXCWSDNMDXSWHS-NSHDSACASA-N 295.404 3.223 70 20 CGID CCOCCCN1CCC[C@H]1c1cccc(F)c1 159444828 QGWXMPVVJOTSEI-HNNXBMFYSA-N 251.345 3.389 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1ccc2cc[nH]c2c1 159547231 KJDDPRZPVVSPCJ-OAHLLOKOSA-N 298.386 3.390 70 20 CGID O=C(Oc1ccc2ccccc2c1)[C@@H]1CCCCO1 159382471 KCZDALLZDVWIBM-HNNXBMFYSA-N 256.301 3.314 70 20 CGID CNC(=O)c1ccc(NCc2cc(Cl)ccc2F)cc1 160702040 WCYSGVDYTUXQLH-UHFFFAOYSA-N 292.741 3.451 70 20 CGID CCC(CC)NC(=O)NCc1ccc(Cl)cc1 217304912 RQJLHUWCQGCRTD-UHFFFAOYSA-N 254.761 3.328 70 20 CGID CCn1nccc1CN(C)Cc1cccc(Cl)c1 161130814 MJDQEMMLDLSYQR-UHFFFAOYSA-N 263.772 3.188 70 20 CGID Cc1nnc(NC(=O)N[C@@H]2CCCc3sccc32)s1 161165663 LMPAZQBMTGXSOO-SECBINFHSA-N 294.405 3.107 70 20 CGID CC(C)[C@@H](NC(=O)NO[C@H]1CCCCO1)c1ccccc1 161491354 ZWICXYQHOAVTHE-LSDHHAIUSA-N 292.379 3.141 70 20 CGID CCn1cc(C(=O)O[C@@H](C)c2cc(C)ccc2OC)cn1 160158374 NIIOJMMTXPYYDI-LBPRGKRZSA-N 288.347 3.138 70 20 CGID CCc1cc(NC(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)n(C)n1 160424132 NHLAUFLFMTUQQH-MLGOLLRUSA-N 298.390 3.207 70 20 CGID CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccnn1C(C)C 160521828 LIDVXGIAERZHPC-KBPBESRZSA-N 294.443 3.159 70 20 CGID CC(C)CCc1noc(CN2CC[C@@H]3CCCC[C@@H]32)n1 160558885 HMGUISMNPIRCSH-KBPBESRZSA-N 277.412 3.423 70 20 CGID Cc1n[nH]cc1CN(C)Cc1ccc(Br)cc1 160804527 PLISPTSPGAJVCS-UHFFFAOYSA-N 294.196 3.113 70 20 CGID Cc1cc(N[C@H](C)c2ccc(F)cc2F)nn1C 159651597 FXWPYWFNLYPWGG-SECBINFHSA-N 251.280 3.180 70 20 CGID CCc1cccc(C)c1NC(=O)NCCc1cscn1 159497955 CUSQIJVWFCYPQV-UHFFFAOYSA-N 289.404 3.378 70 20 CGID CC(C)c1cccc(NC(=O)N[C@]2(C)CCOC2)c1 159696266 BASUQRLROOHJSL-OAHLLOKOSA-N 262.353 3.111 70 20 CGID COc1cccc(CCCN(C)C[C@H]2CCCCO2)c1 159536663 AVUPPYLGXRSSII-QGZVFWFLSA-N 277.408 3.129 70 20 CGID CC[C@@H](c1ccncc1)N(C)S(=O)(=O)CCC(C)(C)C 159742251 OQUMEDCCPWFZIR-AWEZNQCLSA-N 298.452 3.231 70 20 CGID Cc1ccccc1[C@@H](C)SCCN1CCOCC1 159772157 QNKDWOZKUJQEJX-CQSZACIVSA-N 265.422 3.121 70 20 CGID CCn1ccnc(NC2CC(C)(C)CC(C)(C)C2)c1=O 159386660 NEOCXAXIBYUQMN-UHFFFAOYSA-N 277.412 3.280 70 20 CGID O[C@H](CNCc1coc2ccccc12)c1ccccc1 159801719 VRYKJVVOVVRIAG-MRXNPFEDSA-N 267.328 3.256 70 20 CGID COc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2OC)cc1OC 217885355 PYNPPTSIFMSYOF-NWANDNLSSA-N 293.407 3.312 70 20 CGID CC[C@@H](C)CN(CC)C(=O)c1ccncc1Br 159667183 XOTSRDVEJRZNDJ-SNVBAGLBSA-N 299.212 3.352 70 20 CGID COc1ccc(CN(C)Cc2ccsc2)c(OC)c1 160839575 BBVQWSGCHFQTEC-UHFFFAOYSA-N 277.389 3.397 70 20 CGID O=C(c1ccc2[nH]ccc2c1)N1[C@H]2C=CC[C@H]1CC2 218728566 BHILNJCUKWMEJV-KBPBESRZSA-N 252.317 3.101 70 20 CGID Cc1ccc([C@@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)o1 161126900 BMKJRCPKYKPEMF-MCIONIFRSA-N 250.386 3.111 70 20 CGID Nc1ccc(C(=O)N2CCSC3(CCCCC3)C2)cc1 161450152 YRHVUUJZHYCWMR-UHFFFAOYSA-N 290.432 3.161 70 20 CGID CCCCO[C@@H](C)C(=O)N[C@H]1CCCc2sccc21 160186119 QRIPUDIZSFGOPS-AAEUAGOBSA-N 281.421 3.447 70 20 CGID CCOC(=O)c1ccc(CN(C)Cc2cccc(F)c2)o1 160471183 MPVXCMKIFAXUPD-UHFFFAOYSA-N 291.322 3.227 70 20 CGID CCN(CCCO)C(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2 160528717 BCYHAZFOKWOALW-JGAFYBCUSA-N 293.451 3.214 70 20 CGID C[C@@H](CC1CCCC1)C(=O)N(C)Cc1cccn1C 160725522 QBIHOOKVNJOKNR-ZDUSSCGKSA-N 262.397 3.200 70 20 CGID CC(C)CSCCCNC(=O)c1c(F)cccc1F 160847790 IMFNZCTVDISHTA-UHFFFAOYSA-N 287.375 3.474 70 20 CGID O=C(Cc1c[nH]c2ccc(F)cc12)NCC1(C2CC2)CC1 159690280 XUVOOXVEURFOAB-UHFFFAOYSA-N 286.350 3.156 70 20 CGID C[C@H](C(=O)NCC1(C2CC2)CC1)c1cccc(F)c1 159721127 XDTACEBRQXOSKM-NSHDSACASA-N 261.340 3.236 70 20 CGID Cc1cccc(C(=O)NC[C@H](O)c2ccccc2)c1Cl 160378336 ATASXQYABUVIDV-AWEZNQCLSA-N 289.762 3.112 70 20 CGID CSC[C@@H](CCO)N[C@H](C)c1cccc(Cl)c1 160282634 ZFVYNGHDKQWETE-ZWNOBZJWSA-N 273.829 3.105 70 20 CGID CSC[C@@H](CCO)N[C@H](C)c1ccc2c(c1)CCCC2 160367489 LVKNOJHVTZAOLE-CXAGYDPISA-N 293.476 3.330 70 20 CGID O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@@H]1C[C@@H]1C1CC1 160457231 FPJQHUIVMARMDK-RBSFLKMASA-N 277.408 3.031 70 20 CGID CCC[C@@H](Nc1cccc(OCCF)c1)C(=O)OCC 160888190 XLAXVSUZPPFVBT-CQSZACIVSA-N 283.343 3.179 70 20 CGID C[C@H]1CCC[C@@H](NC(=O)N2CCC3(CCC3)C2)C1 160916119 WKWSTBFXIVTVSS-QWHCGFSZSA-N 250.386 3.151 70 20 CGID CCc1ncsc1C(=O)Nc1ncc(Cl)s1 160994617 AZYOZRWWKFPTRZ-UHFFFAOYSA-N 273.770 3.068 70 20 CGID CCCNC(=O)COc1ccc(Cc2ccccc2)cc1 159429521 ZATSPJRPEHDWTB-UHFFFAOYSA-N 283.371 3.182 70 20 CGID CCCCn1ncc(C(=O)N[C@H]2CCCC[C@@H]2C)c1C 159636777 JKNHUJKGEUJGTJ-WFASDCNBSA-N 277.412 3.300 70 20 CGID C[C@]1(CNC(=O)N[C@@H]2CCc3ccccc32)CCCS1 159510581 HELUFNIPLJPDCP-GDBMZVCRSA-N 290.432 3.259 70 20 CGID C[C@H](O)C[C@H]1CCCCN1CCCc1ccccc1 159981265 PYUXLTSCNVWTBE-DOTOQJQBSA-N 261.409 3.245 70 20 CGID CC1(C)C[C@@H](NCc2cccc3cc[nH]c23)CCO1 160438460 YBZPXYMORAXGKA-AWEZNQCLSA-N 258.365 3.215 70 20 CGID Cc1ccc(C(=O)N2CCS[C@@H]3CCCC[C@@H]32)cc1N 161430738 HVAJYLVPTWRXMR-LSDHHAIUSA-N 290.432 3.077 70 20 CGID C[C@H](N[C@@H]1CCN2CCCC[C@@H]12)c1cc(F)ccc1F 217672761 CKDMFKCRYLGAIE-XZJROXQQSA-N 280.362 3.242 70 20 CGID CO[C@@H]1CCCC[C@H]1N[C@@H](C)Cc1ccc(F)cc1 217909253 GGJFKOKBPDAWLA-APHBMKBZSA-N 265.372 3.304 70 20 CGID CC(C)CNCCCN(C(=O)OC(C)(C)C)C1CC1 218098686 IFHHZJUIWUJWLM-UHFFFAOYSA-N 270.417 3.022 70 20 CGID CCc1ccc(NC2CCC(NC(C)=O)CC2)cc1 161081645 NWZMNYIJBYVTDX-UHFFFAOYSA-N 260.381 3.108 70 20 CGID CC[C@H](c1ccccc1)S(=O)(=O)Cc1nccs1 161214987 PSKIBNZSTPUBOL-GFCCVEGCSA-N 281.402 3.209 70 20 CGID Cc1nn(-c2ccccc2)cc1C(=O)NCC1(C2CC2)CC1 160031513 LOJGTSXOJUXXSP-UHFFFAOYSA-N 295.386 3.101 70 20 CGID CSC[C@H](CCO)N[C@@H](C)c1ccc(OC(C)C)cc1 160323788 WAJUSBUXIMPIAP-ZFWWWQNUSA-N 297.464 3.238 70 20 CGID CC[C@@H](C(=O)NC[C@H](OC)C(C)(C)C)c1ccc(F)cc1 160642062 LHEZDINOHIIHMF-CABCVRRESA-N 295.398 3.497 70 20 CGID CCC1CCN(C(=O)Nc2cc(C(=O)OC)cs2)CC1 160682484 QVESJJZCVSOPKU-UHFFFAOYSA-N 296.392 3.189 70 20 CGID CCc1noc(C)c1CSCc1noc(C2CC2)n1 159822605 HHOQIFAMMNJJRS-UHFFFAOYSA-N 279.365 3.239 70 20 CGID Cc1cccc([C@H](NC(=O)c2cc[nH]c2)c2ccccn2)c1 159887637 MLTKIHQBSMFQLF-KRWDZBQOSA-N 291.354 3.238 70 20 CGID O=c1ccc(-c2ccccc2)nn1Cc1ccc(Cl)cn1 159533993 HYXHGVUDTPGCPA-UHFFFAOYSA-N 297.745 3.007 70 20 CGID FC(F)(F)c1ccc(NCC2(C3CC3)CC2)nn1 218077842 SJXWLJNIDFFARI-UHFFFAOYSA-N 257.259 3.098 70 20 CGID C[C@@H]1C[C@H]1C(=O)Nc1cc(F)c(Br)cc1F 160741971 YCJQPBRYPTZJES-PHDIDXHHSA-N 290.107 3.322 70 20 CGID Cc1ccc(Cl)cc1NCc1nnc2n1CCCC2 217317313 MBGNEXXZNPNKSH-UHFFFAOYSA-N 276.771 3.188 70 20 CGID Cc1cccc(C)c1OCCCN[C@@H](C)C1CCOCC1 161238496 OKRGGNLNKVARKT-INIZCTEOSA-N 291.435 3.477 70 20 CGID CC[C@H](NCC1(c2ccc(F)cc2)CC1)c1cnn(C)c1 161349915 YYHPPZRUWWVEFB-INIZCTEOSA-N 287.382 3.332 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1nnc(C(C)C)s1 160230463 DXIZWXYCVAQMJN-QPUJVOFHSA-N 253.371 3.036 70 20 CGID C[C@H]1CCN(C(=O)[C@H]2CCCCO2)c2ccccc2S1 160355437 GNXLFSCNANGSCE-GXTWGEPZSA-N 291.416 3.473 70 20 CGID C[C@H](CCOc1ccccc1)C(=O)Nc1cccc(F)n1 160718264 WULSSDJIZJGLGH-GFCCVEGCSA-N 288.322 3.264 70 20 CGID O=C(NC1CC=CC1)c1cc(-c2cccc(Cl)c2)on1 160773930 PVOWPYWQBQSHQI-UHFFFAOYSA-N 288.734 3.443 70 20 CGID CS(=O)(=O)CCCCSCc1cc(F)ccc1F 160931517 HRXWQMREZVMBRF-UHFFFAOYSA-N 294.388 3.023 70 20 CGID COc1ccc(NC(=O)[C@@H]2CCC[C@H](C)C2)cc1N 161255779 HPYKDDFBCOYBPP-WDEREUQCSA-N 262.353 3.042 70 20 CGID CC(C)c1ncc(CN[C@@H]2CCOC(C)(C)C2)s1 160547915 MIWQHBCTSDGDKF-LLVKDONJSA-N 268.426 3.314 70 20 CGID C[C@H]1C[C@H]1C(=O)Nc1cc(F)c(Br)cc1F 160742111 YCJQPBRYPTZJES-NTSWFWBYSA-N 290.107 3.322 70 20 CGID C[C@H](c1cccc2ccccc12)S(=O)(=O)Cl 106524822 SXNOAQWOJVAUJC-SECBINFHSA-N 254.738 3.469 70 20 CGID CN(Cc1cccc(OC(F)(F)F)c1)C(=O)C(C)(C)F 160022655 SCYLYQALFHJTDF-UHFFFAOYSA-N 293.260 3.292 70 20 CGID Cc1[nH]c(SCc2ccnn2C)nc1Cc1ccccc1 161186447 KINOYSISEXNKRS-UHFFFAOYSA-N 298.415 3.335 70 20 CGID Cc1cc(C(=O)NCC2(c3ccccc3)CCCC2)ncn1 161352662 DSPHKXJWZFOBQJ-UHFFFAOYSA-N 295.386 3.027 70 20 CGID COc1cc(NCC(=O)Nc2ccccc2C)ccc1F 160267308 GZAWKQJBQQGAQY-UHFFFAOYSA-N 288.322 3.193 70 20 CGID CCS[C@@H](C(=O)Nc1cc(C2CC2)nc(C)n1)C(C)C 160318214 LVJWQPJCKPTOOF-CQSZACIVSA-N 293.436 3.379 70 20 CGID C[C@@H]1CCN(C(=O)[C@@H]2CCCCO2)c2ccccc2S1 160355048 GNXLFSCNANGSCE-OCCSQVGLSA-N 291.416 3.473 70 20 CGID Cc1cc(N(C)C)ccc1NC(=O)N[C@H](C)C1CCC1 160820929 OVZRAFXEDBXYOI-GFCCVEGCSA-N 275.396 3.371 70 20 CGID C[C@@H]1CCC[C@@H](NC(=O)N2CCC3(CCC3)C2)C1 160916029 WKWSTBFXIVTVSS-CHWSQXEVSA-N 250.386 3.151 70 20 CGID COC[C@H](NC(=O)Nc1cccc(C(F)F)c1)C1CC1 159822553 AOHYBQUCCGRECX-LBPRGKRZSA-N 284.306 3.171 70 20 CGID CC1CCC(C)(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)CC1 159659493 PNNPEVDITUMUJT-WSYIQSFVSA-N 294.439 3.212 70 20 CGID CC[C@@H]1CCC[C@H]1NC(=O)Cc1ccc(O)cc1Cl 159498387 DJXSCBZMUBNEDG-QMTHXVAHSA-N 281.783 3.283 70 20 CGID COc1ccc([C@H](C)N[C@H]2CCOC(C)(C)C2)c(F)c1 159952598 LBGFUWGIIPWTGO-RYUDHWBXSA-N 281.371 3.443 70 20 CGID CC1(C)CC[C@H](COC(=O)c2ccc(N)c(Cl)c2)O1 160792952 ASYMLDUFFOZISJ-SNVBAGLBSA-N 283.755 3.037 70 20 CGID COc1ccc2cc(NC(=O)CCc3ccco3)ccc2n1 216672967 JSTVABRNUUMAJT-UHFFFAOYSA-N 296.326 3.408 70 20 CGID Cc1ccc(CCNC(=O)NCCCc2ccccc2)cc1 217307956 FFHVVSQAMUVKAD-UHFFFAOYSA-N 296.414 3.470 70 20 CGID CCCCNC(=O)C(=O)Nc1ccccc1SC(C)C 161020367 XUBSFJZSFHSZFN-UHFFFAOYSA-N 294.420 3.042 70 20 CGID C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)c(F)c1 161131854 DBSLORBFQDQLEA-XBFCOCLRSA-N 282.378 3.488 70 20 CGID CCCN(CCO)Cc1cc(Cl)cc(Cl)c1OC 161219109 VKNACOKVXWPWQI-UHFFFAOYSA-N 292.206 3.206 70 20 CGID Cc1cccc(N(C)C(=O)COc2cc(C)ccc2F)c1 161245091 UUWFFFHVKXULNK-UHFFFAOYSA-N 287.334 3.484 70 20 CGID CC(C)(C)c1cnc([S@](=O)Cc2nccs2)s1 160694213 KJKBWTHJTKJMGH-KRWDZBQOSA-N 286.447 3.205 70 20 CGID CC(C)N(Cc1cc(C(N)=O)cs1)C1CCCCC1 159772069 LMLDHLRHLGCWFT-UHFFFAOYSA-N 280.437 3.390 70 20 CGID Cc1cccc(C)c1NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1 161064655 PDGOYQYFGGCAJW-LSDHHAIUSA-N 288.391 3.383 70 20 CGID Cc1nc2ncnn2c(N[C@@H]2CCCc3sccc32)c1C 161072151 CPDNBNVXDKNWRR-GFCCVEGCSA-N 299.403 3.292 70 20 CGID Cc1nc(CC(=O)N2CCC[C@@H]3CCC[C@H]32)c(C)s1 161324788 BTNXNPWGGBYZDW-GXTWGEPZSA-N 278.421 3.094 70 20 CGID CCCn1nc(C)c(C(=O)N(C)Cc2ccsc2)c1C 161508069 HEUCRINLUBLBKO-UHFFFAOYSA-N 291.420 3.244 70 20 CGID CC(Cl)(Cl)C(=O)N[C@H]1CCCc2sccc21 160204020 JOJTZCXPWIIXCK-QMMMGPOBSA-N 278.204 3.436 70 20 CGID CCc1ccc(CCC(=O)N(C)Cc2cccn2C)cc1 160442589 RPBPFVMSNIXENC-UHFFFAOYSA-N 284.403 3.179 70 20 CGID O[C@H]1CCCC[C@@H]1CN[C@H]1CCCOc2ccc(F)cc21 160495471 YVSVQXVSIQVRRO-KCXAZCMYSA-N 293.382 3.180 70 20 CGID CC(=O)c1ccc(NC(=O)c2cnn(CC(C)C)c2C)cc1 160556531 MFDAIAIPXCLLKS-UHFFFAOYSA-N 299.374 3.302 70 20 CGID O=C(NCC1(C2CC2)CCC1)N[C@@H]1[C@H]2Cc3ccccc3[C@H]21 160581787 HHRNTCPUAMHIHX-GVDBMIGSSA-N 296.414 3.204 70 20 CGID CCn1ccnc1CN(Cc1cccc(F)c1)C1CC1 160814414 TZVZYHPGIVAYGN-UHFFFAOYSA-N 273.355 3.207 70 20 CGID C[C@@]1(O)CCCN(C(=O)Nc2cccc(C(F)F)c2)C1 160854629 OSNYNZVQQONZBO-CQSZACIVSA-N 284.306 3.003 70 20 CGID Cc1ncc([C@H](C)NCc2ccc(CN(C)C)cc2)c(C)n1 160866080 JBZUFTRZJNZQNS-ZDUSSCGKSA-N 298.434 3.006 70 20 CGID COCCC1(CNC(=O)NCC2(C)CCCC2)CCCC1 159868019 DJBRUGDYQQPRBR-UHFFFAOYSA-N 296.455 3.463 70 20 CGID Cc1c(C(=O)N(C)[C@@H](C)c2ccco2)cnn1CC(C)C 159869529 RDILAUKVKYSRJA-ZDUSSCGKSA-N 289.379 3.274 70 20 CGID CCOCCCN1CCC(OCCc2ccccc2)CC1 159715278 LKEUUPRFXVFCJE-UHFFFAOYSA-N 291.435 3.137 70 20 CGID CCC(CC)C(=O)N[C@@H]1CCOC2(CCCC2)C1 159923318 NPXTWWIKFNQMFW-CYBMUJFWSA-N 253.386 3.031 70 20 CGID Cc1ccsc1[C@H]1C[C@@H]1C(=O)N[C@@H](C)c1cccnc1 159748316 IUNXMDXOAFPCRI-UBHSHLNASA-N 286.400 3.432 70 20 CGID CCc1ccc2nc(NC(=O)[C@@H]3CCCCO3)sc2c1 159788428 RXULJMOIFBZHIT-LBPRGKRZSA-N 290.388 3.366 70 20 CGID CCSCC[C@H](C)NCc1cnc2ccccc2n1 160069176 VXTFPKIYBOIUSH-LBPRGKRZSA-N 275.421 3.251 70 20 CGID CC1(C)CC[C@H](COC(=O)c2ccc(Cl)c(N)c2)O1 160778977 VVGYSEGPHYRGLD-SNVBAGLBSA-N 283.755 3.037 70 20 CGID CCC(=O)N1CC[C@@H](c2cccc(Br)c2)C1 217244267 DDKFQAGOOXIWBO-LLVKDONJSA-N 282.181 3.175 70 20 CGID CCC(=O)N1CC[C@H](c2cccc(Br)c2)C1 217244266 DDKFQAGOOXIWBO-NSHDSACASA-N 282.181 3.175 70 20 CGID CC[C@H](C)N(C)CCNCc1ccc([C@@H]2C[C@@H]2C)o1 217399503 JXTXXEMTASOZKD-KCQAQPDRSA-N 264.413 3.223 70 20 CGID CC[C@@H]1CCCC[C@@H]1N(C)C(=O)CC[C@@H]1CCOC1 161000953 IEEFMSHILOPLTK-KFWWJZLASA-N 267.413 3.230 70 20 CGID CC[C@@H]1CCCC[C@H]1NCc1cccc(C(=O)N(C)C)c1 161410400 GPWUUNNEPQUKNL-NVXWUHKLSA-N 288.435 3.447 70 20 CGID C[C@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C[C@@H]1C 160010772 GRXPZBUUZLYWKT-UWVGGRQHSA-N 267.760 3.245 70 20 CGID O=C(N[C@@H]1CCOC2(CCCC2)C1)c1c(F)cccc1F 160170091 VSEJPPCNRMSLJS-LLVKDONJSA-N 295.329 3.186 70 20 CGID COc1ccc(N(C)C(=O)c2scnc2C)cc1Cl 160217296 BACTUOSOKKNUKG-UHFFFAOYSA-N 296.779 3.390 70 20 CGID Cc1ccc(NC(=O)NOCC(C)C)cc1OC(F)F 160337524 HHJYYXTYAWGUDT-UHFFFAOYSA-N 288.294 3.306 70 20 CGID CS[C@H](C)CC(=O)Nc1cccc(-c2cnco2)c1 160468856 UFWUMAKAKZDAHE-SNVBAGLBSA-N 276.361 3.422 70 20 CGID CC(C)[C@H](C)N(C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)C1CC1 160624489 XJERCGUZJMZTQR-BJJXKVORSA-N 294.439 3.163 70 20 CGID CC[C@H](N[C@@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1F 160927919 OTYCPFVNTOXFEB-LSDHHAIUSA-N 296.361 3.015 70 20 CGID Cc1cccc(NC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1C 160932278 RPRVHUVMQBXITO-GOEBONIOSA-N 288.391 3.383 70 20 CGID COc1ccc(N(C)C(=O)CC[C@H]2CC[C@@H](C)O2)cc1F 159456639 FUVGLTHSXYYGLB-DGCLKSJQSA-N 295.354 3.145 70 20 CGID C[C@H](NC(=O)[C@H](C)Cc1ccc(Cl)cc1)C1CC1 159701424 SWEYIFPFEDYNRI-MNOVXSKESA-N 265.784 3.433 70 20 CGID Cc1ccccc1C[C@@H](C)NC(=O)NC1(C)CCC1 159547890 CPAZOPXBFPGFHA-CYBMUJFWSA-N 260.381 3.168 70 20 CGID CC(C)CN1CCOc2ccc(Br)cc21 217240226 MCGUIBWTMLBIBP-UHFFFAOYSA-N 270.170 3.304 70 20 CGID Fc1ccc(F)c(OCc2noc3c2CCCC3)c1 217011386 BXRFUCJZGNLMQT-UHFFFAOYSA-N 265.259 3.411 70 20 CGID CC[C@H](c1ccc(F)cc1)N1CCC[C@@H](CNC(C)=O)C1 217237935 GKTANAVMOBXBAI-WMLDXEAASA-N 292.398 3.125 70 20 CGID CC[C@@H](NCCCN(C)C)c1cccc(Cl)c1F 161480517 KNUFYCXHPBIYFA-CYBMUJFWSA-N 272.795 3.472 70 20 CGID CCOc1cc(Cl)ccc1NC(=O)[C@H]1CCC[C@@H](N)C1 161502102 XMNHZNFAAQDCTG-CMPLNLGQSA-N 296.798 3.195 70 20 CGID C[C@@H]1CN(C(=O)C2CCC(C)(C)CC2)CCS1 160018766 ZBGQYGRZBMWTLC-LLVKDONJSA-N 255.427 3.167 70 20 CGID CCc1noc(C)c1CSCCC(=O)N1CCC[C@@H]1C 160052041 NPKMBFOILPNMFK-NSHDSACASA-N 296.436 3.180 70 20 CGID CC1(NC(=O)NCCCc2c[nH]c3ccccc23)CCC1 160967143 NFJNMDQQCYUOER-UHFFFAOYSA-N 285.391 3.342 70 20 CGID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCCOCC1CC1 159847356 PVKJPSIXCPUUFW-KGLIPLIRSA-N 293.432 3.093 70 20 CGID CCc1cccc(NC(=O)N[C@H](CC)[C@@H]2CCCO2)c1 159459668 ZSIQCQATOCMRPL-CABCVRRESA-N 276.380 3.328 70 20 CGID CCCCc1ccc(NC(=O)N[C@H]2CC[C@H](O)CC2)cc1 159856149 DKEUHMOIKGUISJ-IYBDPMFKSA-N 290.407 3.454 70 20 CGID C[C@]1(NC(=O)Nc2cccc(Cl)c2Cl)CCOC1 159377763 AJKRARLUBNLNLA-LBPRGKRZSA-N 289.162 3.294 70 20 CGID CCC(C)(CC)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 159377933 OTIWNRCHNMCJKP-MJBXVCDLSA-N 279.424 3.277 70 20 CGID CCCCn1ncc(NC(=O)N[C@@H]2CCCSC2)c1C 159772398 HLXACCHVYQAEPR-GFCCVEGCSA-N 296.440 3.009 70 20 CGID CCCC(=O)Nc1cccc(NC(=O)CO[C@@H](C)CC)c1 159390626 GAUFKVYETKVEQI-LBPRGKRZSA-N 292.379 3.179 70 20 CGID CC1(C)C[C@H](NCc2cnc(C(C)(C)C)s2)CCO1 160434921 DRYHTUVLQRIMGC-LLVKDONJSA-N 282.453 3.488 70 20 CGID CCOc1ccc(CNC(=O)NCc2ccccc2C)cc1 217301055 FEPDQXUTDLHQNZ-UHFFFAOYSA-N 298.386 3.393 70 20 CGID CCCN(CCC)C(=O)Cc1c[nH]c2ccc(OC)cc12 218508739 BZJJVUYRNCADPT-UHFFFAOYSA-N 288.391 3.368 70 20 CGID CCN(Cc1ccccc1)C(=O)c1ccc(OC)cc1F 218444422 NPQLTUPGZISLQS-UHFFFAOYSA-N 287.334 3.497 70 20 CGID CC(C)OC1CCC(NC(=O)CCC2CC2)CC1 159510988 VCRRVDLNKSVPRP-UHFFFAOYSA-N 253.386 3.029 70 20 CGID CC(C)CC(CC(C)C)NC(=O)[C@@H]1CCn2ccnc2C1 161410180 VYNAEPMSIXOVGX-CQSZACIVSA-N 291.439 3.023 70 20 CGID CCO[C@H](C)c1noc(COc2ccc3[nH]ccc3c2)n1 160072782 SYRNUKPISUAVEB-SNVBAGLBSA-N 287.319 3.227 70 20 CGID CC[C@H](NC(=O)CCCCSC)c1c(C)noc1C 160311864 YITWGSZNNOJJRN-LBPRGKRZSA-N 284.425 3.392 70 20 CGID CC1(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1 160163539 GQBDUZRGBCKUFJ-UHFFFAOYSA-N 257.255 3.122 70 20 CGID CCc1nc2cc(NC(=O)NOCC(C)C)ccc2o1 160380184 HKUDCONOSVPVSD-UHFFFAOYSA-N 277.324 3.099 70 20 CGID CN(Cc1cccn1C)C(=O)CCc1ccc(Cl)s1 160626124 WGMWWAMTFLBRDB-UHFFFAOYSA-N 296.823 3.331 70 20 CGID CN(C[C@H](O)C1CC1)C1c2ccccc2-c2ccccc21 160808564 YKHHOTITQBAGSP-SFHVURJKSA-N 279.383 3.459 70 20 CGID CCCC(=O)N(C)[C@H]1CCCc2nc(CC)sc21 160987617 MABWGVJPTKVDSF-NSHDSACASA-N 266.410 3.341 70 20 CGID CC[C@H](C(=O)Nc1ccc(OC(C)C)c(C)c1)N(C)C 159812398 ILZOMTIDFBBAKH-CQSZACIVSA-N 278.396 3.061 70 20 CGID CCC[C@@H]1CN(C(=O)c2ccc(Cl)c(F)c2)CCO1 159458273 BUZWIFBBPQZZCW-LLVKDONJSA-N 285.746 3.120 70 20 CGID COc1cc(C(=O)Nc2cccc(C)c2O)ccc1F 159876489 GEJZXSCBGJSPRI-UHFFFAOYSA-N 275.279 3.101 70 20 CGID O=C(Cc1ccc(Cl)cc1)NCC1(C2CC2)CC1 159776985 UFRSVYQRMJJTDS-UHFFFAOYSA-N 263.768 3.189 70 20 CGID Cc1cnc([C@H](C)NC(=O)N[C@H](C)CC(C)C)s1 159394695 FRIPOHYDSZTSRT-KOLCDFICSA-N 269.414 3.246 70 20 CGID CCN(CCCO)C(=O)c1oc2ccc(Cl)cc2c1C 160495046 UCAALGJREBPZQU-UHFFFAOYSA-N 295.766 3.239 70 20 CGID C[C@H](CNCc1ccc(Cl)cc1F)N1CCCCC1 160785213 WIZUEQKQRFBXHI-GFCCVEGCSA-N 284.806 3.443 70 20 CGID CC[C@H](N[C@@H](C)Cc1ccccc1C)[C@H]1CCOC1 160770950 RGAIBWZPPWBVHA-XIRDDKMYSA-N 261.409 3.331 70 20 CGID CCc1n[nH]c(-c2ccccc2NC(=O)CC2CCC2)n1 161333461 LBRWUOVUMSICMZ-UHFFFAOYSA-N 284.363 3.163 70 20 CGID CSC[C@H]1CCCN1c1nc(C(C)(C)C)ns1 160013904 GNIVSUIWXQDVDP-SECBINFHSA-N 271.455 3.167 70 20 CGID CC(=O)c1c[nH]c(C(=O)N[C@@H]2CCCc3sccc32)c1 160049155 IAXRLCOPBQZZSN-GFCCVEGCSA-N 288.372 3.086 70 20 CGID Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccccn1 160374599 ZVYWWJWVJXMSIY-GHMZBOCLSA-N 258.346 3.194 70 20 CGID Cc1cccc(C)c1CN[C@@H](C)c1nnc2ccccn12 160415831 RFDOVUAGMIMATK-AWEZNQCLSA-N 280.375 3.197 70 20 CGID CN(Cc1cccn1C)C(=O)CCCC1CCCC1 160499626 VWKGTKZPKVXVNT-UHFFFAOYSA-N 262.397 3.344 70 20 CGID CCCCn1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c1C 160932700 HZNZRKAJDLQOFU-STQMWFEESA-N 277.412 3.110 70 20 CGID C[C@@H]1CCN(C(N)=O)[C@@H]1c1ccc(C(F)(F)F)cc1 160949403 WQOCEFBAFYJSPW-KCJUWKMLSA-N 272.270 3.167 70 20 CGID CSc1cc(C(=O)NCCOCCC(C)C)ccc1F 159635146 NRAZVAHSHLJTHD-UHFFFAOYSA-N 299.411 3.340 70 20 CGID Cc1cccc([C@@H]2CCCN2Cc2cn3ccccc3n2)n1 159884935 IQQMMLMEJFQSBF-KRWDZBQOSA-N 292.386 3.375 70 20 CGID C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@@H]1CCCSC1 159533653 GMLRIVQQKPLOHX-SMDDNHRTSA-N 296.411 3.028 70 20 CGID Cc1cnc(C(=O)N2C[C@H](C)CSc3ccccc32)cn1 159558147 UGMYUWHTCCKCTK-NSHDSACASA-N 299.399 3.174 70 20 CGID Cc1ccc(NC(=O)c2ccn(C3CCCC3)n2)c(O)c1 159569079 TUXCJNXUWOWCPA-UHFFFAOYSA-N 285.347 3.265 70 20 CGID CCCCn1ncc(NC(=O)N[C@@H]2C=CCCC2)c1C 159766767 OZVCCAGXSOAWQB-CYBMUJFWSA-N 276.384 3.222 70 20 CGID C[C@H](CCn1cccn1)Nc1cccc2ncccc12 159393088 FCAWFQZXYPQECL-CYBMUJFWSA-N 266.348 3.322 70 20 CGID CC[C@H](NC(=O)Nc1cc(C)cc(C)c1)[C@@H]1CCCO1 159398470 QUDNZIVYFUFTDS-GJZGRUSLSA-N 276.380 3.383 70 20 CGID CC[C@@H](NCC(=O)NCC(C)C)c1cccc(Cl)c1 159381562 FYWQIYRORFHSFU-CQSZACIVSA-N 282.815 3.153 70 20 CGID CC(C)(O)CCNc1ccc(F)c(Br)c1 159934213 SXTFIVUSXFPAMP-UHFFFAOYSA-N 276.149 3.161 70 20 CGID CON(C)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 218122009 LPGQSCALJYICHA-IUCAKERBSA-N 274.147 3.117 70 20 CGID Cc1cc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)nn1C 161170583 XBXADKGFOKPCEO-MGPQQGTHSA-N 275.396 3.274 70 20 CGID COCCC(=O)N1CCCC[C@@H]1CCCc1ccccc1 161179323 UTWKYHUSHWJLSX-QGZVFWFLSA-N 289.419 3.427 70 20 CGID CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1cc(C(C)=O)cn1C 161283168 OQXAJYRUEOFABA-ZFWWWQNUSA-N 290.407 3.269 70 20 CGID Cc1ccc(-c2cnn(Cc3nccs3)c2)cc1 161300697 CWNRJUJZWGPRCH-UHFFFAOYSA-N 255.346 3.363 70 20 CGID COc1cccc2c1CC[C@@H]2NC(=O)c1sccc1C 160155519 RNXLUEKNKALKHC-ZDUSSCGKSA-N 287.384 3.482 70 20 CGID CC(C)C1CCN(C(=O)N[C@H]2CCO[C@@H](C3CC3)C2)CC1 160279965 OFGBOKNQGRZOON-JKSUJKDBSA-N 294.439 3.022 70 20 CGID CC(C)(C(=O)NCc1cccc2c1OCO2)C1CCCC1 160771776 KZEJHWDEKLQNKM-UHFFFAOYSA-N 289.375 3.248 70 20 CGID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cccc(NC(C)=O)c1C 160925521 VOFBDUAODMTROE-WBMJQRKESA-N 274.364 3.328 70 20 CGID Cc1ccc([C@@H](Cc2ccccc2)NCCO)cc1C 159717054 MYCBQUXOOIRBAL-GOSISDBHSA-N 269.388 3.169 70 20 CGID COc1ccc2c(c1)C[C@H](N[C@@H]1CCOC(C)(C)C1)CC2 159975922 PVZBAYRNGIKKMV-HZPDHXFCSA-N 289.419 3.100 70 20 CGID COc1cc(NCc2ccc(OC)c(OC)c2)ccc1F 159983575 MMZCRUSYUHZGJU-UHFFFAOYSA-N 291.322 3.464 70 20 CGID Nc1ccc2c(c1)CCC[C@@H]2Nc1ncccc1F 159494172 KFEBWGBGWFUZAQ-AWEZNQCLSA-N 257.312 3.292 70 20 CGID CCCCOCCCNC(=O)NCCc1ccc(C)cc1 217307739 HCOQAXVMBHJZTJ-UHFFFAOYSA-N 292.423 3.044 70 20 CGID COc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@@H](N(C)C)C1)CC2 161040924 LVJSSZIPJCKBBH-IIDMSEBBSA-N 288.435 3.145 70 20 CGID Cc1cccc(C)c1OCCCN[C@@H]1CCN(C)C[C@@H]1C 161234540 HBYRTFVHLPHQMG-DLBZAZTESA-N 290.451 3.002 70 20 CGID C[C@H]1CC[C@@H](C)N1c1cnc2cc(F)c(F)cc2n1 161447003 UCOYEQUSECFPFM-DTORHVGOSA-N 263.291 3.285 70 20 CGID C[C@H]1C[C@H]1c1cc(NC(=O)CC2CCSCC2)[nH]n1 160317823 HLQKVCJCKMSZRA-GXSJLCMTSA-N 279.409 3.005 70 20 CGID CC(C)(CO)CCCNC(=O)/C=C/c1ccc(Cl)cc1 160387387 PFQHGGTUTYLOJX-RMKNXTFCSA-N 295.810 3.268 70 20 CGID CC1(C)Cc2occc2[C@H](NC[C@H]2CCCC[C@@H]2O)C1 160517942 FPYBXADWWRIKNH-YUELXQCFSA-N 277.408 3.434 70 20 CGID CC[C@@H](NC(=O)CCCCCCN)c1cc(F)ccc1F 160656905 QBUCIWMMMVSBKX-OAHLLOKOSA-N 298.377 3.441 70 20 CGID CC[C@@H](C)C(=O)NOCc1ccc(C(F)(F)F)cc1 160662245 PDAPRLCYPDEVPY-SECBINFHSA-N 275.270 3.299 70 20 CGID COc1ccc(Br)cc1CS[C@@H](C)CO 160710052 LXPFCMRIWZSHIT-QMMMGPOBSA-N 291.210 3.072 70 20 CGID CC1(C)CCCC[C@@H]1Nc1cc(=O)n2ccccc2n1 160712326 LGLLIKKFQFMJDT-LBPRGKRZSA-N 271.364 3.075 70 20 CGID CCC[C@H](C(=O)NOCc1cccnc1)c1ccccc1 160796387 MWBFXMSWKSLWCT-INIZCTEOSA-N 284.359 3.213 70 20 CGID Cc1ccc(SCCN[C@H]2CCN(C)C[C@@H]2C)cc1 160793965 LOBPMGLTZJHDQF-HOCLYGCPSA-N 278.465 3.017 70 20 CGID CCn1cc([C@H](C)N[C@H](CCCO)c2ccccc2)cn1 160813104 JMHOHANQQXIYOV-WMLDXEAASA-N 287.407 3.067 70 20 CGID CC[C@@H]1CN(CCn2ccnc2)CC[C@@H]1c1ccccc1 159865326 FTOOSMOVMIVCDM-AEFFLSMTSA-N 283.419 3.399 70 20 CGID Cc1nccc(NC(=O)N2[C@@H](C)CC[C@@H]2C)c1Cl 159758157 WHPMWEKRAYZPAN-IUCAKERBSA-N 267.760 3.448 70 20 CGID O=C(COC/C=C/c1ccccc1)Nc1ccccc1O 159575351 YDMWIPGXYOWZRE-RMKNXTFCSA-N 283.327 3.061 70 20 CGID C[C@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc2[nH]cnc12 159575918 LZIOJLVRMWRYBZ-ZOWXZIJZSA-N 283.375 3.356 70 20 CGID CCc1noc(C)c1CNc1ccccc1-n1cccn1 159394206 IJMOWCBZACCVPM-UHFFFAOYSA-N 282.347 3.343 70 20 CGID CC(=O)Nc1cccc(Cn2nc(C3CC3)nc2C2CC2)c1 161476094 RKIRCBPVGVZRER-UHFFFAOYSA-N 296.374 3.040 70 20 CGID COc1ccc([C@H](C)CC(=O)NCC2(C3CC3)CC2)cc1 160012058 WJUWIVLUMJAORD-CYBMUJFWSA-N 287.403 3.495 70 20 CGID CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)CCCN 160079681 NJVXHSVMRBEYIU-HNNXBMFYSA-N 282.815 3.234 70 20 CGID CC[C@]1(C)C[C@H]1C(=O)Nc1cc(C2CC2)nc(C)n1 160275182 PFKKXVWAJHWUJH-XHDPSFHLSA-N 259.353 3.037 70 20 CGID CCc1ccc(NC(=O)N[C@@H]2CCOC(C)(C)C2)cc1 160842074 KCTPEKPXBBPYMC-CQSZACIVSA-N 276.380 3.328 70 20 CGID CCOC(=O)CCc1ccc(NC(=O)N[C@H](C)CC)cc1 159662771 XVKHFLNXGAVOJW-GFCCVEGCSA-N 292.379 3.102 70 20 CGID CCc1ccc(/C=C/C(=O)N(C)[C@@H](C)c2ccncc2)o1 159497456 RDAUWOUDSJMINO-GWJCSSMESA-N 284.359 3.470 70 20 CGID CCCN(C)[C@H](C)c1nc(Cc2ccccc2)no1 159780309 FBZPEYBYAQSKSF-GFCCVEGCSA-N 259.353 3.063 70 20 CGID CCCn1nccc1CNC[C@H](C)c1ccccc1 159983650 DTEXBDFRZFFVMZ-AWEZNQCLSA-N 257.381 3.186 70 20 CGID